quinolin-8-yl (1E)-N-[(2-methylphenyl)amino]-2-oxidanylidene-propanimidothioate

Systemtic Name: quinolin-8-yl (1E)-N-[(2-methylphenyl)amino]-2-oxidanylidene-propanimidothioate Openeye Name: 8-quinolyl (1E)-N-(2-methylanilino)-2-oxo-propanimidothioate CAS Name: (1E)-N-(2-methylanilino)-2-oxopropanimidothioic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (1E)-N-(2-methylanilino)-2-oxopropanimidothioate Traditional Name: (1E)-2-keto-N-(o-toluidino)thiopropionimidic acid 8-quinolyl ester Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NN=C(C(=O)C)SC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N/N=C(\C(=O)C)/SC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C19H17N3OS/c1-13-7-3-4-10-16(13)21-22-19(14(2)23)24-17-11-5-8-15-9-6-12-20-18(15)17/h3-12,21H,1-2H3/b22-19+