N2-(2-aminocarbonyl-3-azanyl-2-oxidanyl-4-phenyl-butanoyl)-N3-(6-azanyl-1-oxidanylidene-1-phenylazanyl-hexan-2-yl)oxirane-2,3-dicarboxamide

Systemtic Name: N2-(2-aminocarbonyl-3-azanyl-2-oxidanyl-4-phenyl-butanoyl)-N3-(6-azanyl-1-oxidanylidene-1-phenylazanyl-hexan-2-yl)oxirane-2,3-dicarboxamide Openeye Name: N2-(3-amino-2-carbamoyl-2-hydroxy-4-phenyl-butanoyl)-N3-[5-amino-1-(phenylcarbamoyl)pentyl]oxirane-2,3-dicarboxamide CAS Name: N3-(6-amino-1-anilino-1-oxohexan-2-yl)-N2-(3-amino-2-carbamoyl-2-hydroxy-1-oxo-4-phenylbutyl)oxirane-2,3-dicarboxamide IUPAC Name: 3-N-(6-amino-1-anilino-1-oxohexan-2-yl)-2-N-(3-amino-2-carbamoyl-2-hydroxy-4-phenylbutanoyl)oxirane-2,3-dicarboxamide Traditional Name: N-(3-amino-2-carbamoyl-2-hydroxy-4-phenyl-butanoyl)-N'-[5-amino-1-(phenylcarbamoyl)pentyl]oxirane-2,3-dicarboxamide Formula: C27H34N6O7 MolecularWeight: 554.59486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C(=O)N)(C(=O)NC(=O)C2C(O2)C(=O)NC(CCCCN)C(=O)NC3=CC=CC=C3)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C(=O)N)(C(=O)NC(=O)C2C(O2)C(=O)NC(CCCCN)C(=O)NC3=CC=CC=C3)O)N

InChI

InChI=1S/C27H34N6O7/c28-14-8-7-13-18(22(34)31-17-11-5-2-6-12-17)32-23(35)20-21(40-20)24(36)33-26(38)27(39,25(30)37)19(29)15-16-9-3-1-4-10-16/h1-6,9-12,18-21,39H,7-8,13-15,28-29H2,(H2,30,37)(H,31,34)(H,32,35)(H,33,36,38)