6-(azepan-1-ylsulfonyl)-1-methyl-4-oxidanylidene-N-(3-propan-2-yloxypropyl)quinoline-3-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-1-methyl-4-oxidanylidene-N-(3-propan-2-yloxypropyl)quinoline-3-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-(3-isopropoxypropyl)-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-1-methyl-4-oxo-N-(3-propan-2-yloxypropyl)-3-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-1-methyl-4-oxo-N-(3-propan-2-yloxypropyl)quinoline-3-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-(3-isopropoxypropyl)-4-keto-1-methyl-quinoline-3-carboxamide Formula: C23H33N3O5S MolecularWeight: 463.59022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C23H33N3O5S/c1-17(2)31-14-8-11-24-23(28)20-16-25(3)21-10-9-18(15-19(21)22(20)27)32(29,30)26-12-6-4-5-7-13-26/h9-10,15-17H,4-8,11-14H2,1-3H3,(H,24,28)