N-[2-[[4-[2-(2-azanyl-3-phenyl-propanoyl)hydrazinyl]-4-oxidanylidene-butanoyl]-cyclopropyl-amino]ethyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-[[4-[2-(2-azanyl-3-phenyl-propanoyl)hydrazinyl]-4-oxidanylidene-butanoyl]-cyclopropyl-amino]ethyl]pyrazine-2-carboxamide Openeye Name: N-[2-[[4-[2-(2-amino-3-phenyl-propanoyl)hydrazino]-4-oxo-butanoyl]-cyclopropyl-amino]ethyl]pyrazine-2-carboxamide CAS Name: N-[2-[[4-[(2-amino-1-oxo-3-phenylpropyl)hydrazo]-1,4-dioxobutyl]-cyclopropylamino]ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-[[4-[2-(2-amino-3-phenylpropanoyl)hydrazinyl]-4-oxobutanoyl]-cyclopropylamino]ethyl]pyrazine-2-carboxamide Traditional Name: N-[2-[cyclopropyl-[4-keto-4-(N'-phenylalanylhydrazino)butanoyl]amino]ethyl]pyrazinamide Formula: C23H29N7O4 MolecularWeight: 467.52086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CCNC(=O)C2=NC=CN=C2)C(=O)CCC(=O)NNC(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

C1CC1N(CCNC(=O)C2=NC=CN=C2)C(=O)CCC(=O)NNC(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C23H29N7O4/c24-18(14-16-4-2-1-3-5-16)22(33)29-28-20(31)8-9-21(32)30(17-6-7-17)13-12-27-23(34)19-15-25-10-11-26-19/h1-5,10-11,15,17-18H,6-9,12-14,24H2,(H,27,34)(H,28,31)(H,29,33)