N-(4-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

InChI

InChI=1S/C19H19N3O3S2/c1-12-5-3-7-16-17(12)20-19(26-16)21-18(23)14-8-9-15-13(11-14)6-4-10-22(15)27(2,24)25/h3,5,7-9,11H,4,6,10H2,1-2H3,(H,20,21,23)