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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,3s)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-10-yl]-3-phenylurea

Preferred term

1-[(2s,3s)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-10-yl]-3-phenylurea  

Type

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

Broader concept

charge

  • 0

formula

  • C30H34Cl2N4O4

inchi

  • InChI=1S/C30H34Cl2N4O4/c1-19-15-36(20(2)18-37)29(38)23-10-7-11-26(34-30(39)33-22-8-5-4-6-9-22)28(23)40-27(19)17-35(3)16-21-12-13-24(31)25(32)14-21/h4-14,19-20,27,37H,15-18H2,1-3H3,(H2,33,34,39)/t19-,20-,27+/m0/s1

inchikey

  • ORCUQVZUTYUDHO-OWOAZTCBSA-N

mass

  • 585.522

monoisotopicmass

  • 584.19571

smiles

  • C[C@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)NC3=CC=CC=C3)O[C@@H]1CN(C)CC4=CC(=C(C=C4)Cl)Cl)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:95240

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