6-(azepan-1-ylsulfonyl)-N-[2-[bis(2-methylpropyl)amino]ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[2-[bis(2-methylpropyl)amino]ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[2-(diisobutylamino)ethyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[2-[bis(2-methylpropyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[2-[bis(2-methylpropyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-[2-(diisobutylamino)ethyl]-2-keto-1H-quinoline-4-carboxamide Formula: C26H40N4O4S MolecularWeight: 504.6852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)CC(C)C

Isomeric SMILES

CC(C)CN(CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)CC(C)C

InChI

InChI=1S/C26H40N4O4S/c1-19(2)17-29(18-20(3)4)14-11-27-26(32)23-16-25(31)28-24-10-9-21(15-22(23)24)35(33,34)30-12-7-5-6-8-13-30/h9-10,15-16,19-20H,5-8,11-14,17-18H2,1-4H3,(H,27,32)(H,28,31)