N-[[4-(aminomethyl)phenyl]carbamoyl]-N-[1-oxidanylidene-3-phenyl-1-(propylamino)propan-2-yl]oxirane-2-carboxamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]carbamoyl]-N-[1-oxidanylidene-3-phenyl-1-(propylamino)propan-2-yl]oxirane-2-carboxamide Openeye Name: N-[[4-(aminomethyl)phenyl]carbamoyl]-N-[1-benzyl-2-oxo-2-(propylamino)ethyl]oxirane-2-carboxamide CAS Name: N-[[4-(aminomethyl)anilino]-oxomethyl]-N-[1-oxo-3-phenyl-1-(propylamino)propan-2-yl]-2-oxiranecarboxamide IUPAC Name: N-[[4-(aminomethyl)phenyl]carbamoyl]-N-[1-oxo-3-phenyl-1-(propylamino)propan-2-yl]oxirane-2-carboxamide Traditional Name: N-[[4-(aminomethyl)phenyl]carbamoyl]-N-[1-benzyl-2-keto-2-(propylamino)ethyl]oxirane-2-carboxamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(CC1=CC=CC=C1)N(C(=O)C2CO2)C(=O)NC3=CC=C(C=C3)CN

Isomeric SMILES

CCCNC(=O)C(CC1=CC=CC=C1)N(C(=O)C2CO2)C(=O)NC3=CC=C(C=C3)CN

InChI

InChI=1S/C23H28N4O4/c1-2-12-25-21(28)19(13-16-6-4-3-5-7-16)27(22(29)20-15-31-20)23(30)26-18-10-8-17(14-24)9-11-18/h3-11,19-20H,2,12-15,24H2,1H3,(H,25,28)(H,26,30)