N-[3-(azepan-1-yl)propyl]-6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-6-(1-azepanylsulfonyl)-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-6-(azepan-1-ylsulfonyl)-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-6-(azepan-1-ylsulfonyl)-2-keto-1H-quinoline-4-carboxamide Formula: C25H36N4O4S MolecularWeight: 488.64274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H36N4O4S/c30-24-19-22(25(31)26-12-9-15-28-13-5-1-2-6-14-28)21-18-20(10-11-23(21)27-24)34(32,33)29-16-7-3-4-8-17-29/h10-11,18-19H,1-9,12-17H2,(H,26,31)(H,27,30)