1-butyl-N'-(4-methylphenyl)sulfonyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carbohydrazide

Systemtic Name: 1-butyl-N'-(4-methylphenyl)sulfonyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carbohydrazide Openeye Name: 1-butyl-2-hydroxy-4-oxo-N'-(p-tolylsulfonyl)quinoline-3-carbohydrazide CAS Name: 1-butyl-2-hydroxy-N'-(4-methylphenyl)sulfonyl-4-oxo-3-quinolinecarbohydrazide IUPAC Name: 1-butyl-2-hydroxy-N'-(4-methylphenyl)sulfonyl-4-oxoquinoline-3-carbohydrazide Traditional Name: 1-butyl-2-hydroxy-4-keto-N'-tosyl-quinoline-3-carbohydrazide Formula: C21H23N3O5S MolecularWeight: 429.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H23N3O5S/c1-3-4-13-24-17-8-6-5-7-16(17)19(25)18(21(24)27)20(26)22-23-30(28,29)15-11-9-14(2)10-12-15/h5-12,23,27H,3-4,13H2,1-2H3,(H,22,26)