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

Systemtic Name: N-[4-[(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]butanamide Openeye Name: N-[4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]butanamide CAS Name: N-[4-[[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]butanamide IUPAC Name: N-[4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]butanamide Traditional Name: N-[4-[[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]butyramide Formula: C24H25N3O4S2 MolecularWeight: 483.603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O4S2/c1-2-4-23(28)25-19-8-10-21(11-9-19)33(30,31)26-20-7-6-17-12-13-27(16-18(17)15-20)24(29)22-5-3-14-32-22/h3,5-11,14-15,26H,2,4,12-13,16H2,1H3,(H,25,28)