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

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N,2-dimethyl-1,3-benzothiazole-6-sulfonamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S2/c1-14-21-18-8-7-17(11-19(18)27-14)28(25,26)22(2)13-20(24)23-10-9-15-5-3-4-6-16(15)12-23/h3-8,11H,9-10,12-13H2,1-2H3