2-[methyl-(phenylmethyl)amino]ethyl 5-cyano-6-methyl-2-(phenylsulfinylmethyl)-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-[methyl-(phenylmethyl)amino]ethyl 5-cyano-6-methyl-2-(phenylsulfinylmethyl)-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-[benzyl(methyl)amino]ethyl 2-(benzenesulfinylmethyl)-5-cyano-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 2-(benzenesulfinylmethyl)-5-cyano-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid 2-[methyl-(phenylmethyl)amino]ethyl ester IUPAC Name: 2-[benzyl(methyl)amino]ethyl 2-(benzenesulfinylmethyl)-5-cyano-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-(benzenesulfinylmethyl)-5-cyano-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid 2-[benzyl(methyl)amino]ethyl ester Formula: C32H30F3N3O3S MolecularWeight: 593.65911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CS(=O)C2=CC=CC=C2)C(=O)OCCN(C)CC3=CC=CC=C3)C4=CC=CC=C4C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)CS(=O)C2=CC=CC=C2)C(=O)OCCN(C)CC3=CC=CC=C3)C4=CC=CC=C4C(F)(F)F)C#N

InChI

InChI=1S/C32H30F3N3O3S/c1-22-26(19-36)29(25-15-9-10-16-27(25)32(33,34)35)30(28(37-22)21-42(40)24-13-7-4-8-14-24)31(39)41-18-17-38(2)20-23-11-5-3-6-12-23/h3-16,29,37H,17-18,20-21H2,1-2H3