6-butoxy-N-(3-butylsulfanylphenyl)-N,1-dimethyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 6-butoxy-N-(3-butylsulfanylphenyl)-N,1-dimethyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-butoxy-N-(3-butylsulfanylphenyl)-2-hydroxy-N,1-dimethyl-4-oxo-quinoline-3-carboxamide CAS Name: 6-butoxy-N-[3-(butylthio)phenyl]-2-hydroxy-N,1-dimethyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-butoxy-N-(3-butylsulfanylphenyl)-2-hydroxy-N,1-dimethyl-4-oxoquinoline-3-carboxamide Traditional Name: 6-butoxy-N-[3-(butylthio)phenyl]-2-hydroxy-4-keto-N,1-dimethyl-quinoline-3-carboxamide Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)N(C(=C(C2=O)C(=O)N(C)C3=CC(=CC=C3)SCCCC)O)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)N(C(=C(C2=O)C(=O)N(C)C3=CC(=CC=C3)SCCCC)O)C

InChI

InChI=1S/C26H32N2O4S/c1-5-7-14-32-19-12-13-22-21(17-19)24(29)23(26(31)28(22)4)25(30)27(3)18-10-9-11-20(16-18)33-15-8-6-2/h9-13,16-17,31H,5-8,14-15H2,1-4H3