4-methyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-methyl-N-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]thiadiazole-5-carboxamide CAS Name: 4-methyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-5-thiadiazolecarboxamide IUPAC Name: 4-methyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]thiadiazole-5-carboxamide Traditional Name: 4-methyl-N-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=C(N=NS4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=C(N=NS4)C

InChI

InChI=1S/C20H20N4O3S2/c1-13-3-7-18(8-4-13)29(26,27)24-10-9-15-5-6-17(11-16(15)12-24)21-20(25)19-14(2)22-23-28-19/h3-8,11H,9-10,12H2,1-2H3,(H,21,25)