[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl (2S)-2-[(2-chlorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: [1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl (2S)-2-[(2-chlorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: (1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)methyl (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid (1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)methyl ester IUPAC Name: (1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propionic acid (2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)methyl ester Formula: C25H23ClN4O5 MolecularWeight: 494.92692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)COC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H23ClN4O5/c1-29-16(12-22(31)30(2)25(29)34)14-35-24(33)21(28-23(32)18-8-3-5-9-19(18)26)11-15-13-27-20-10-6-4-7-17(15)20/h3-10,12-13,21,27H,11,14H2,1-2H3,(H,28,32)/t21-/m0/s1