N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]-2-methyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H27N3O3S2/c1-15(2)12-21(23(27)26-11-10-17-6-4-5-7-18(17)14-26)25-31(28,29)19-8-9-20-22(13-19)30-16(3)24-20/h4-9,13,15,21,25H,10-12,14H2,1-3H3