6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-N-[(4-methylphenyl)methyl]-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-N-[(4-methylphenyl)methyl]-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-oxo-N-(p-tolylmethyl)quinoline-3-carboxamide CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-N-[(4-methylphenyl)methyl]-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-N-[(4-methylphenyl)methyl]-4-oxoquinoline-3-carboxamide Traditional Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-keto-N-(4-methylbenzyl)quinoline-3-carboxamide Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CC=C(C=C5)C

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CC=C(C=C5)C

InChI

InChI=1S/C29H29N3O4S/c1-3-31-19-26(29(34)30-17-21-10-8-20(2)9-11-21)28(33)25-16-24(12-13-27(25)31)37(35,36)32-15-14-22-6-4-5-7-23(22)18-32/h4-13,16,19H,3,14-15,17-18H2,1-2H3,(H,30,34)