2-(2-azanylpropanoylamino)-N-[1-[2-methanoyl-2,3-bis(4-methylpiperidin-2-yl)pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-(2-azanylpropanoylamino)-N-[1-[2-methanoyl-2,3-bis(4-methylpiperidin-2-yl)pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-methyl-pentanamide Openeye Name: 2-(2-aminopropanoylamino)-N-[1-benzyl-2-[2-formyl-2,3-bis(4-methyl-2-piperidyl)pyrrolidin-1-yl]-2-oxo-ethyl]-3-methyl-pentanamide CAS Name: 2-[(2-amino-1-oxopropyl)amino]-N-[1-[2-formyl-2,3-bis(4-methyl-2-piperidinyl)-1-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide IUPAC Name: 2-(2-aminopropanoylamino)-N-[1-[2-formyl-2,3-bis(4-methylpiperidin-2-yl)pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide Traditional Name: 2-(alanylamino)-N-[1-benzyl-2-[2-formyl-2,3-bis(4-methyl-2-piperidyl)pyrrolidino]-2-keto-ethyl]-3-methyl-valeramide Formula: C35H56N6O4 MolecularWeight: 624.85694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)N2CCC(C2(C=O)C3CC(CCN3)C)C4CC(CCN4)C)NC(=O)C(C)N

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)N2CCC(C2(C=O)C3CC(CCN3)C)C4CC(CCN4)C)NC(=O)C(C)N

InChI

InChI=1S/C35H56N6O4/c1-6-24(4)31(40-32(43)25(5)36)33(44)39-29(20-26-10-8-7-9-11-26)34(45)41-17-14-27(28-18-22(2)12-15-37-28)35(41,21-42)30-19-23(3)13-16-38-30/h7-11,21-25,27-31,37-38H,6,12-20,36H2,1-5H3,(H,39,44)(H,40,43)