dimethyl 2,6-dimethyl-4-[2-(phenylmethylsulfanyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-[2-(phenylmethylsulfanyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(2-benzylsulfanylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[2-(phenylmethylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(2-benzylsulfanylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[2-(benzylthio)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2SCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2SCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H25NO4S/c1-15-20(23(26)28-3)22(21(16(2)25-15)24(27)29-4)18-12-8-9-13-19(18)30-14-17-10-6-5-7-11-17/h5-13,22,25H,14H2,1-4H3