2-oxidanyl-N'-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide

Systemtic Name: 2-oxidanyl-N'-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Openeye Name: 2-hydroxy-N'-[6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoyl]benzohydrazide CAS Name: 2-hydroxy-N'-[1-oxo-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexyl]benzohydrazide IUPAC Name: 2-hydroxy-N'-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Traditional Name: 2-hydroxy-N'-[6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NNC(=O)C3=CC=CC=C3O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NNC(=O)C3=CC=CC=C3O

InChI

InChI=1S/C21H22N4O4S/c26-17-11-6-4-9-15(17)19(28)24-23-18(27)12-2-1-7-13-25-20(29)14-8-3-5-10-16(14)22-21(25)30/h3-6,8-11,26H,1-2,7,12-13H2,(H,22,30)(H,23,27)(H,24,28)