methyl 2-[[2-cyanoethyl-[4-[2-cyanoethyl-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]amino]butyl]carbamoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-cyanoethyl-[4-[2-cyanoethyl-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]amino]butyl]carbamoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[4-[(1-benzyl-2-methoxy-2-oxo-ethyl)carbamoyl-(2-cyanoethyl)amino]butyl-(2-cyanoethyl)carbamoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[2-cyanoethyl-[4-[2-cyanoethyl-[[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]amino]butyl]amino]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-cyanoethyl-[4-[2-cyanoethyl-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)carbamoyl]amino]butyl]carbamoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[(1-benzyl-2-keto-2-methoxy-ethyl)carbamoyl-(2-cyanoethyl)amino]butyl-(2-cyanoethyl)carbamoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C32H40N6O6 MolecularWeight: 604.6966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)N(CCCCN(CCC#N)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)CCC#N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)N(CCCCN(CCC#N)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)CCC#N

InChI

InChI=1S/C32H40N6O6/c1-43-29(39)27(23-25-13-5-3-6-14-25)35-31(41)37(21-11-17-33)19-9-10-20-38(22-12-18-34)32(42)36-28(30(40)44-2)24-26-15-7-4-8-16-26/h3-8,13-16,27-28H,9-12,19-24H2,1-2H3,(H,35,41)(H,36,42)