N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-N-methyl-thiophene-2-sulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-N-methyl-thiophene-2-sulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]-N-methyl-thiophene-2-sulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-N-methyl-2-thiophenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-N-methylthiophene-2-sulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]-N-methyl-thiophene-2-sulfonamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N2O3S2/c1-19(25(22,23)18-9-5-13-24-18)11-4-8-17(21)20-12-10-15-6-2-3-7-16(15)14-20/h2-3,5-7,9,13H,4,8,10-12,14H2,1H3