4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethylthiazol-2-yl)benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethyl-2-thiazolyl)benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dimethylthiazol-2-yl)benzamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C21H21N3O3S2/c1-14-15(2)28-21(22-14)23-20(25)17-7-9-19(10-8-17)29(26,27)24-12-11-16-5-3-4-6-18(16)13-24/h3-10H,11-13H2,1-2H3,(H,22,23,25)