N-(2-butan-2-ylpyrazol-3-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-(2-butan-2-ylpyrazol-3-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-sec-butylpyrazol-3-yl)benzamide CAS Name: N-(2-butan-2-yl-3-pyrazolyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-(2-butan-2-ylpyrazol-3-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-sec-butylpyrazol-3-yl)benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C)N1C(=CC=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H26N4O3S/c1-3-17(2)27-22(12-14-24-27)25-23(28)19-8-10-21(11-9-19)31(29,30)26-15-13-18-6-4-5-7-20(18)16-26/h4-12,14,17H,3,13,15-16H2,1-2H3,(H,25,28)