N-(3,5-dimethylphenyl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(3,5-dimethylphenyl)-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C20H24N2O3S/c1-4-26(24,25)22-13-17-8-6-5-7-16(17)12-19(22)20(23)21-18-10-14(2)9-15(3)11-18/h5-11,19H,4,12-13H2,1-3H3,(H,21,23)