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

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

CCC1C(=C(NC(=C1C(=O)OCC)C2=CC(=CC=C2)Cl)CC)C(=O)SCC

Isomeric SMILES

CCC1C(=C(NC(=C1C(=O)OCC)C2=CC(=CC=C2)Cl)CC)C(=O)SCC

InChI

InChI=1S/C21H26ClNO3S/c1-5-15-17(21(25)27-8-4)16(6-2)23-19(18(15)20(24)26-7-3)13-10-9-11-14(22)12-13/h9-12,15,23H,5-8H2,1-4H3