6-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butan-2-yl]sulfonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butan-2-yl]sulfonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[3-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-3-oxo-propyl]sulfonyl-4H-1,4-benzothiazin-3-one CAS Name: 6-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutan-2-yl]sulfonyl-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutan-2-yl]sulfonyl-4H-1,4-benzothiazin-3-one Traditional Name: 6-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-keto-1-methyl-propyl]sulfonyl-4H-1,4-benzothiazin-3-one Formula: C21H22N2O4S2 MolecularWeight: 430.54038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CC(CC(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H22N2O4S2/c1-14(11-21(25)23-10-4-6-15-5-2-3-7-18(15)23)29(26,27)16-8-9-19-17(12-16)22-20(24)13-28-19/h2-3,5,7-9,12,14H,4,6,10-11,13H2,1H3,(H,22,24)