4-[(3-methylsulfanylphenyl)amino]-6-nitro-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-methylsulfanylphenyl)amino]-6-nitro-quinoline-3-carbonitrile Openeye Name: 4-(3-methylsulfanylanilino)-6-nitro-quinoline-3-carbonitrile CAS Name: 4-[3-(methylthio)anilino]-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-methylsulfanylanilino)-6-nitroquinoline-3-carbonitrile Traditional Name: 4-[3-(methylthio)anilino]-6-nitro-quinoline-3-carbonitrile Formula: C17H12N4O2S MolecularWeight: 336.36778

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC2=C3C=C(C=CC3=NC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NC2=C3C=C(C=CC3=NC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O2S/c1-24-14-4-2-3-12(7-14)20-17-11(9-18)10-19-16-6-5-13(21(22)23)8-15(16)17/h2-8,10H,1H3,(H,19,20)