6-(azepan-1-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxoquinoline-3-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-keto-quinoline-3-carboxamide Formula: C26H30ClN3O4S MolecularWeight: 516.0521

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H30ClN3O4S/c1-2-29-18-23(26(32)28-14-13-19-7-9-20(27)10-8-19)25(31)22-17-21(11-12-24(22)29)35(33,34)30-15-5-3-4-6-16-30/h7-12,17-18H,2-6,13-16H2,1H3,(H,28,32)