N-[4-[(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide

Systemtic Name: N-[4-[(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide Openeye Name: N-[4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide CAS Name: N-[4-[[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide IUPAC Name: N-[4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide Traditional Name: N-[4-[[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propionamide Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

InChI

InChI=1S/C23H23N3O4S2/c1-2-22(27)24-18-7-9-20(10-8-18)32(29,30)25-19-6-5-16-11-12-26(15-17(16)14-19)23(28)21-4-3-13-31-21/h3-10,13-14,25H,2,11-12,15H2,1H3,(H,24,27)