N-(3-ethanoylphenyl)-3-methylsulfonyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-3-methylsulfonyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-(3-acetylphenyl)-3-methylsulfonyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-(3-acetylphenyl)-3-methylsulfonyl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(3-acetylphenyl)-3-methylsulfonyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-(3-acetylphenyl)-3-mesyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CC3=CC=CC=C3CC2S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CC3=CC=CC=C3CC2S(=O)(=O)C

InChI

InChI=1S/C19H20N2O4S/c1-13(22)14-8-5-9-17(10-14)20-19(23)21-12-16-7-4-3-6-15(16)11-18(21)26(2,24)25/h3-10,18H,11-12H2,1-2H3,(H,20,23)