5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide Openeye Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide CAS Name: 5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N,N-diethyl-1-methyl-3-pyrrolesulfonamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-1-methylpyrrole-3-sulfonamide Traditional Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C19H25N3O3S/c1-4-22(5-2)26(24,25)17-12-18(20(3)14-17)19(23)21-11-10-15-8-6-7-9-16(15)13-21/h6-9,12,14H,4-5,10-11,13H2,1-3H3