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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-9-[[cyclopropyl(oxo)methyl]amino]-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzamide
... > organooxygen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-9-[[cyclopropyl(oxo)methyl]amino]-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > n-(2-aminophenyl)-4-[[[(2r,3s)-9-[[cyclopropyl(oxo)methyl]amino]-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzamide

Preferred term

n-(2-aminophenyl)-4-[[[(2r,3s)-9-[[cyclopropyl(oxo)methyl]amino]-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C35H43N5O5

inchi

  • InChI=1S/C35H43N5O5/c1-22-18-40(23(2)21-41)33(42)17-27-16-28(37-34(43)26-12-13-26)14-15-31(27)45-32(22)20-39(3)19-24-8-10-25(11-9-24)35(44)38-30-7-5-4-6-29(30)36/h4-11,14-16,22-23,26,32,41H,12-13,17-21,36H2,1-3H3,(H,37,43)(H,38,44)/t22-,23+,32-/m0/s1

inchikey

  • YCMQTTLPFMFYTR-YBBGPBPVSA-N

mass

  • 613.748

monoisotopicmass

  • 613.32642

smiles

  • C[C@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3CC3)O[C@H]1CN(C)CC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:124254

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