N-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-[3-nitro-4-(p-tolylsulfanyl)phenyl]methyleneamino]pyridine-4-carboxamide CAS Name: N-[(E)-[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-[3-nitro-4-(p-tolylthio)benzylidene]amino]isonicotinamide Formula: C20H16N4O3S MolecularWeight: 392.43104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O3S/c1-14-2-5-17(6-3-14)28-19-7-4-15(12-18(19)24(26)27)13-22-23-20(25)16-8-10-21-11-9-16/h2-13H,1H3,(H,23,25)/b22-13+