2,6-dimethyl-4-(4-methylsulfanylphenyl)-N3,N5-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide

Systemtic Name: 2,6-dimethyl-4-(4-methylsulfanylphenyl)-N3,N5-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide Openeye Name: 2,6-dimethyl-4-(4-methylsulfanylphenyl)-N3,N5-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide CAS Name: 2,6-dimethyl-4-[4-(methylthio)phenyl]-N3,N5-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide IUPAC Name: 2,6-dimethyl-4-(4-methylsulfanylphenyl)-3-N,5-N-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide Traditional Name: 2,6-dimethyl-4-[4-(methylthio)phenyl]-N,N'-bis(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide Formula: C28H25N5O6S MolecularWeight: 559.593

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)SC)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)SC)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H25N5O6S/c1-16-24(27(34)30-19-6-4-8-21(14-19)32(36)37)26(18-10-12-23(40-3)13-11-18)25(17(2)29-16)28(35)31-20-7-5-9-22(15-20)33(38)39/h4-15,26,29H,1-3H3,(H,30,34)(H,31,35)