ethyl 2-(3-chlorophenyl)-5-ethylsulfanylcarbonyl-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 2-(3-chlorophenyl)-5-ethylsulfanylcarbonyl-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 2-(3-chlorophenyl)-5-ethylsulfanylcarbonyl-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylate CAS Name: 2-(3-chlorophenyl)-5-[(ethylthio)-oxomethyl]-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chlorophenyl)-5-ethylsulfanylcarbonyl-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-(3-chlorophenyl)-5-(ethylthio)carbonyl-6-methyl-4-propyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C21H26ClNO3S MolecularWeight: 407.95404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=C(NC(=C1C(=O)OCC)C2=CC(=CC=C2)Cl)C)C(=O)SCC

Isomeric SMILES

CCCC1C(=C(NC(=C1C(=O)OCC)C2=CC(=CC=C2)Cl)C)C(=O)SCC

InChI

InChI=1S/C21H26ClNO3S/c1-5-9-16-17(21(25)27-7-3)13(4)23-19(18(16)20(24)26-6-2)14-10-8-11-15(22)12-14/h8,10-12,16,23H,5-7,9H2,1-4H3