N-(3-butylsulfanylpropyl)-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(3-butylsulfanylpropyl)-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(3-butylsulfanylpropyl)-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[3-(butylthio)propyl]-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(3-butylsulfanylpropyl)-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxoquinoline-3-carboxamide Traditional Name: N-[3-(butylthio)propyl]-6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-keto-quinoline-3-carboxamide Formula: C26H39N3O4S2 MolecularWeight: 521.73556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)CC

Isomeric SMILES

CCCCSCCCNC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)CC

InChI

InChI=1S/C26H39N3O4S2/c1-4-6-16-34-17-10-15-27-26(31)23-19-29(5-2)24-14-13-21(18-22(24)25(23)30)35(32,33)28(3)20-11-8-7-9-12-20/h13-14,18-20H,4-12,15-17H2,1-3H3,(H,27,31)