N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]propane-1-sulfonamide

Systemtic Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]propane-1-sulfonamide Openeye Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]propane-1-sulfonamide CAS Name: N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-propanesulfonamide IUPAC Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]propane-1-sulfonamide Traditional Name: N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)propane-1-sulfonamide Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

Isomeric SMILES

CCCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

InChI

InChI=1S/C16H24N2O3S/c1-4-9-22(20,21)17-15-6-5-13-7-8-18(11-14(13)10-15)16(19)12(2)3/h5-6,10,12,17H,4,7-9,11H2,1-3H3