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

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethyl-4-oxo-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethyl-4-oxoquinoline-3-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethyl-4-keto-quinoline-3-carboxamide Formula: C30H39N3O6S MolecularWeight: 569.71216

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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)OCC)OCC

Isomeric SMILES

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

InChI

InChI=1S/C30H39N3O6S/c1-4-32-21-25(30(35)31-16-15-22-11-14-27(38-5-2)28(19-22)39-6-3)29(34)24-20-23(12-13-26(24)32)40(36,37)33-17-9-7-8-10-18-33/h11-14,19-21H,4-10,15-18H2,1-3H3,(H,31,35)