N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H22N4O3S2/c1-3-19-23-24-21(29-19)22-20(26)18-12-15-6-4-5-7-16(15)13-25(18)30(27,28)17-10-8-14(2)9-11-17/h4-11,18H,3,12-13H2,1-2H3,(H,22,24,26)