methyl (Z)-5-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]amino]-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pent-3-enoate

Systemtic Name: methyl (Z)-5-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]amino]-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pent-3-enoate Openeye Name: methyl (Z)-4-(benzyloxycarbonylamino)-5-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]amino]-5-oxo-pent-3-enoate CAS Name: (Z)-5-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-5-oxo-4-(phenylmethoxycarbonylamino)-3-pentenoic acid methyl ester IUPAC Name: methyl (Z)-5-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-5-oxo-4-(phenylmethoxycarbonylamino)pent-3-enoate Traditional Name: (Z)-4-(benzyloxycarbonylamino)-5-keto-5-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]amino]pent-3-enoic acid methyl ester Formula: C26H31N3O6 MolecularWeight: 481.54084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(=CCC(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)/C(=C/CC(=O)OC)/NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H31N3O6/c1-18(2)16-22(25(32)27-20-12-8-5-9-13-20)28-24(31)21(14-15-23(30)34-3)29-26(33)35-17-19-10-6-4-7-11-19/h4-14,18,22H,15-17H2,1-3H3,(H,27,32)(H,28,31)(H,29,33)/b21-14-/t22-/m0/s1