N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)butane-1-sulfonamide

Systemtic Name: N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)butane-1-sulfonamide Openeye Name: N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]butane-1-sulfonamide CAS Name: N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-1-butanesulfonamide IUPAC Name: N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]butane-1-sulfonamide Traditional Name: N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]butane-1-sulfonamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C3=CC=CS3)C=C1

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C3=CC=CS3)C=C1

InChI

InChI=1S/C18H22N2O3S2/c1-2-3-11-25(22,23)19-16-7-6-14-8-9-20(13-15(14)12-16)18(21)17-5-4-10-24-17/h4-7,10,12,19H,2-3,8-9,11,13H2,1H3