N-(3-cyclohexylsulfanylpropyl)-6-[(3-methoxyphenyl)sulfamoyl]-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-6-[(3-methoxyphenyl)sulfamoyl]-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[3-(cyclohexylthio)propyl]-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-[3-(cyclohexylthio)propyl]-4-keto-6-[(3-methoxyphenyl)sulfamoyl]-1H-quinoline-3-carboxamide Formula: C26H31N3O5S2 MolecularWeight: 529.67144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCCSC4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCCSC4CCCCC4

InChI

InChI=1S/C26H31N3O5S2/c1-34-19-8-5-7-18(15-19)29-36(32,33)21-11-12-24-22(16-21)25(30)23(17-28-24)26(31)27-13-6-14-35-20-9-3-2-4-10-20/h5,7-8,11-12,15-17,20,29H,2-4,6,9-10,13-14H2,1H3,(H,27,31)(H,28,30)