methyl 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-(4-butoxyphenyl)sulfinyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C25H28ClNO4S MolecularWeight: 474.01212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)C2=C(NC(=C(C2C3=CC=CC=C3Cl)C(=O)OC)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)C2=C(NC(=C(C2C3=CC=CC=C3Cl)C(=O)OC)C)C

InChI

InChI=1S/C25H28ClNO4S/c1-5-6-15-31-18-11-13-19(14-12-18)32(29)24-17(3)27-16(2)22(25(28)30-4)23(24)20-9-7-8-10-21(20)26/h7-14,23,27H,5-6,15H2,1-4H3