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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-oxoquinoline-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1-ethyl-4-keto-quinoline-3-carboxamide Formula: C29H28ClN3O4S MolecularWeight: 550.06832

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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)NCCC5=CC=C(C=C5)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C(=O)NCCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H28ClN3O4S/c1-2-32-19-26(29(35)31-15-13-20-7-9-23(30)10-8-20)28(34)25-17-24(11-12-27(25)32)38(36,37)33-16-14-21-5-3-4-6-22(21)18-33/h3-12,17,19H,2,13-16,18H2,1H3,(H,31,35)