3-(azepan-1-ylcarbonyl)-N-methyl-4-oxidanylidene-N-(4-propan-2-ylphenyl)-1H-quinoline-6-sulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-methyl-4-oxidanylidene-N-(4-propan-2-ylphenyl)-1H-quinoline-6-sulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(4-isopropylphenyl)-N-methyl-4-oxo-1H-quinoline-6-sulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-methyl-4-oxo-N-(4-propan-2-ylphenyl)-1H-quinoline-6-sulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-methyl-4-oxo-N-(4-propan-2-ylphenyl)-1H-quinoline-6-sulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-keto-N-methyl-N-p-cumenyl-1H-quinoline-6-sulfonamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCCCCC4

InChI

InChI=1S/C26H31N3O4S/c1-18(2)19-8-10-20(11-9-19)28(3)34(32,33)21-12-13-24-22(16-21)25(30)23(17-27-24)26(31)29-14-6-4-5-7-15-29/h8-13,16-18H,4-7,14-15H2,1-3H3,(H,27,30)