methyl N-[[3-[[4-azanyl-4-oxidanylidene-2-(quinolin-2-ylcarbonylamino)butanoyl]amino]-2-oxidanylidene-4-phenyl-butyl]-propan-2-yl-amino]carbamate

Systemtic Name: methyl N-[[3-[[4-azanyl-4-oxidanylidene-2-(quinolin-2-ylcarbonylamino)butanoyl]amino]-2-oxidanylidene-4-phenyl-butyl]-propan-2-yl-amino]carbamate Openeye Name: methyl N-[[3-[[4-amino-4-oxo-2-(quinoline-2-carbonylamino)butanoyl]amino]-2-oxo-4-phenyl-butyl]-isopropyl-amino]carbamate CAS Name: N-[[3-[[4-amino-1,4-dioxo-2-[[oxo(2-quinolinyl)methyl]amino]butyl]amino]-2-oxo-4-phenylbutyl]-propan-2-ylamino]carbamic acid methyl ester IUPAC Name: methyl N-[[3-[[4-amino-4-oxo-2-(quinoline-2-carbonylamino)butanoyl]amino]-2-oxo-4-phenylbutyl]-propan-2-ylamino]carbamate Traditional Name: N-[[3-[[4-amino-4-keto-2-(quinaldoylamino)butanoyl]amino]-2-keto-4-phenyl-butyl]-isopropyl-amino]carbamic acid methyl ester Formula: C29H34N6O6 MolecularWeight: 562.61686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C2=NC3=CC=CC=C3C=C2)NC(=O)OC

Isomeric SMILES

CC(C)N(CC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C2=NC3=CC=CC=C3C=C2)NC(=O)OC

InChI

InChI=1S/C29H34N6O6/c1-18(2)35(34-29(40)41-3)17-25(36)23(15-19-9-5-4-6-10-19)32-28(39)24(16-26(30)37)33-27(38)22-14-13-20-11-7-8-12-21(20)31-22/h4-14,18,23-24H,15-17H2,1-3H3,(H2,30,37)(H,32,39)(H,33,38)(H,34,40)