1-(2-sulfanylphenyl)carbonyl-2H-quinoline-2-carbonitrile

Systemtic Name: 1-(2-sulfanylphenyl)carbonyl-2H-quinoline-2-carbonitrile Openeye Name: 1-(2-sulfanylbenzoyl)-2H-quinoline-2-carbonitrile CAS Name: 1-[(2-mercaptophenyl)-oxomethyl]-2H-quinoline-2-carbonitrile IUPAC Name: 1-(2-sulfanylbenzoyl)-2H-quinoline-2-carbonitrile Traditional Name: 1-(2-mercaptobenzoyl)-2H-quinoline-2-carbonitrile Formula: C17H12N2OS MolecularWeight: 292.35498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(N2C(=O)C3=CC=CC=C3S)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(N2C(=O)C3=CC=CC=C3S)C#N

InChI

InChI=1S/C17H12N2OS/c18-11-13-10-9-12-5-1-3-7-15(12)19(13)17(20)14-6-2-4-8-16(14)21/h1-10,13,21H