N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide Openeye Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-(8-quinolylsulfanylmethyl)benzamide CAS Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-[(8-quinolinylthio)methyl]benzamide IUPAC Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide Traditional Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-4-[(8-quinolylthio)methyl]benzamide Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)CSC2=CC=CC3=C2N=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)CSC2=CC=CC3=C2N=CC=C3)/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O3S/c1-17(21-6-2-8-22(15-21)29(31)32)27-28-25(30)20-12-10-18(11-13-20)16-33-23-9-3-5-19-7-4-14-26-24(19)23/h2-15H,16H2,1H3,(H,28,30)/b27-17+