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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)-10-(dimethylamino)-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

Preferred term

1-[[(2s,3r)-10-(dimethylamino)-5-[(2r)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea  

Type

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

Broader concept

charge

  • 0

formula

  • C26H36N4O5

inchi

  • InChI=1S/C26H36N4O5/c1-17-14-30(18(2)16-31)25(32)21-8-7-9-22(28(3)4)24(21)35-23(17)15-29(5)26(33)27-19-10-12-20(34-6)13-11-19/h7-13,17-18,23,31H,14-16H2,1-6H3,(H,27,33)/t17-,18-,23-/m1/s1

inchikey

  • VOLWMNYWHGFNTD-PMAPCBKXSA-N

mass

  • 484.589

monoisotopicmass

  • 484.26857

smiles

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

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:124442

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