ethanol; 2-methyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-N-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Systemtic Name: ethanol; 2-methyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-N-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Openeye Name: ethanol; 2-methyl-4-(4-methylsulfanylphenyl)-5-oxo-N-(3-pyridyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide CAS Name: ethanol; 2-methyl-4-[4-(methylthio)phenyl]-5-oxo-N-(3-pyridinyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide IUPAC Name: ethanol; 2-methyl-4-(4-methylsulfanylphenyl)-5-oxo-N-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Traditional Name: ethanol; 5-keto-2-methyl-4-[4-(methylthio)phenyl]-N-(3-pyridyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)SC)C(=O)NC4=CN=CC=C4

Isomeric SMILES

CCO.CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)SC)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C23H23N3O2S.C2H6O/c1-14-20(23(28)26-16-5-4-12-24-13-16)21(15-8-10-17(29-2)11-9-15)22-18(25-14)6-3-7-19(22)27;1-2-3/h4-5,8-13,21,25H,3,6-7H2,1-2H3,(H,26,28);3H,2H2,1H3