5-[(4-methylsulfanylphenyl)methylamino]-2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Systemtic Name: 5-[(4-methylsulfanylphenyl)methylamino]-2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Openeye Name: 5-[(4-methylsulfanylphenyl)methylamino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide CAS Name: 5-[[4-(methylthio)phenyl]methylamino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide IUPAC Name: 5-[(4-methylsulfanylphenyl)methylamino]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Traditional Name: 2-keto-5-[[4-(methylthio)benzyl]amino]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC2CCCC3=C2C=C(C(=O)N3)C(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)CNC2CCCC3=C2C=C(C(=O)N3)C(=O)N

InChI

InChI=1S/C18H21N3O2S/c1-24-12-7-5-11(6-8-12)10-20-15-3-2-4-16-13(15)9-14(17(19)22)18(23)21-16/h5-9,15,20H,2-4,10H2,1H3,(H2,19,22)(H,21,23)