O4-[2-[[2-(4-chlorophenyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] O3,O5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O4-[2-[[2-(4-chlorophenyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] O3,O5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O4-[2-[2-(4-chlorophenyl)sulfanylanilino]-2-oxo-ethyl] O3,O5-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-[2-[(4-chlorophenyl)thio]anilino]-2-oxoethyl] ester O3,O5-diethyl ester IUPAC Name: 4-O-[2-[2-(4-chlorophenyl)sulfanylanilino]-2-oxoethyl] 3-O,5-O-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-[2-[(4-chlorophenyl)thio]anilino]-2-keto-ethyl] ester O3,O5-diethyl ester Formula: C28H29ClN2O7S MolecularWeight: 573.05706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C(=O)OCC)C)C

InChI

InChI=1S/C28H29ClN2O7S/c1-5-36-26(33)23-16(3)30-17(4)24(27(34)37-6-2)25(23)28(35)38-15-22(32)31-20-9-7-8-10-21(20)39-19-13-11-18(29)12-14-19/h7-14,25,30H,5-6,15H2,1-4H3,(H,31,32)