6-(azepan-1-ylsulfonyl)-N-cyclopentyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-cyclopentyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-cyclopentyl-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-cyclopentyl-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-cyclopentyl-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-cyclopentyl-4-keto-1-methyl-quinoline-3-carboxamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NC4CCCC4

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NC4CCCC4

InChI

InChI=1S/C22H29N3O4S/c1-24-15-19(22(27)23-16-8-4-5-9-16)21(26)18-14-17(10-11-20(18)24)30(28,29)25-12-6-2-3-7-13-25/h10-11,14-16H,2-9,12-13H2,1H3,(H,23,27)