dimethyl 2-(2-formamidoethylsulfanylmethyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2-(2-formamidoethylsulfanylmethyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2-(2-formamidoethylsulfanylmethyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[(2-formamidoethylthio)methyl]-6-methyl-4-[2-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(2-formamidoethylsulfanylmethyl)-6-methyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(2-formamidoethylthio)methyl]-6-methyl-4-[2-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CSCCNC=O)C(=O)OC)C2=CC=CC=C2SC)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)CSCCNC=O)C(=O)OC)C2=CC=CC=C2SC)C(=O)OC

InChI

InChI=1S/C21H26N2O5S2/c1-13-17(20(25)27-2)18(14-7-5-6-8-16(14)29-4)19(21(26)28-3)15(23-13)11-30-10-9-22-12-24/h5-8,12,18,23H,9-11H2,1-4H3,(H,22,24)