5-[(2-methylsulfanylpyridin-3-yl)carbonylamino]-2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Systemtic Name: 5-[(2-methylsulfanylpyridin-3-yl)carbonylamino]-2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Openeye Name: 5-[(2-methylsulfanylpyridine-3-carbonyl)amino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide CAS Name: 5-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide IUPAC Name: 5-[(2-methylsulfanylpyridine-3-carbonyl)amino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Traditional Name: 2-keto-5-[[2-(methylthio)nicotinoyl]amino]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2CCCC3=C2C=C(C(=O)N3)C(=O)N

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2CCCC3=C2C=C(C(=O)N3)C(=O)N

InChI

InChI=1S/C17H18N4O3S/c1-25-17-9(4-3-7-19-17)15(23)20-12-5-2-6-13-10(12)8-11(14(18)22)16(24)21-13/h3-4,7-8,12H,2,5-6H2,1H3,(H2,18,22)(H,20,23)(H,21,24)