2-methylsulfanyl-N-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]pyridine-3-carboxamide Openeye Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(1-besyl-3,4-dihydro-2H-quinolin-7-yl)-2-(methylthio)nicotinamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2=CC3=C(CCCN3S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2=CC3=C(CCCN3S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C22H21N3O3S2/c1-29-22-19(10-5-13-23-22)21(26)24-17-12-11-16-7-6-14-25(20(16)15-17)30(27,28)18-8-3-2-4-9-18/h2-5,8-13,15H,6-7,14H2,1H3,(H,24,26)