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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > ureas > 1-[[(2s,3r)-9-(dimethylamino)-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-fluorophenyl)-1-methylurea

Preferred term

1-[[(2s,3r)-9-(dimethylamino)-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-fluorophenyl)-1-methylurea  

Type

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

Broader concept

charge

  • 0

formula

  • C26H35FN4O4

inchi

  • InChI=1S/C26H35FN4O4/c1-17-14-31(18(2)16-32)25(33)13-19-12-22(29(3)4)10-11-23(19)35-24(17)15-30(5)26(34)28-21-8-6-20(27)7-9-21/h6-12,17-18,24,32H,13-16H2,1-5H3,(H,28,34)/t17-,18-,24-/m1/s1

inchikey

  • QZTNYMXCSYRQRM-QZTZHPFYSA-N

mass

  • 486.580

monoisotopicmass

  • 486.26423

smiles

  • C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)N(C)C)O[C@@H]1CN(C)C(=O)NC3=CC=C(C=C3)F)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:130597

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