O5-ethyl O3-methyl 2-(4-cyanobutylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; methanamide

Systemtic Name: O5-ethyl O3-methyl 2-(4-cyanobutylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; methanamide Openeye Name: O5-ethyl O3-methyl 2-(4-cyanobutylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; formamide CAS Name: 2-[(4-cyanobutylthio)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester; formamide IUPAC Name: 5-O-ethyl 3-O-methyl 2-(4-cyanobutylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; formamide Traditional Name: 2-[(4-cyanobutylthio)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester; formamide Formula: C24H30N4O7S MolecularWeight: 518.5826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CSCCCCC#N)C.C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CSCCCCC#N)C.C(=O)N

InChI

InChI=1S/C23H27N3O6S.CH3NO/c1-4-32-23(28)19-15(2)25-18(14-33-12-7-5-6-11-24)21(22(27)31-3)20(19)16-9-8-10-17(13-16)26(29)30;2-1-3/h8-10,13,20,25H,4-7,12,14H2,1-3H3;1H,(H2,2,3)