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

Systemtic Name: N'-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Openeye Name: N'-[6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoyl]benzohydrazide CAS Name: N'-[1-oxo-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexyl]benzohydrazide IUPAC Name: N'-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Traditional Name: N'-[6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C21H22N4O3S/c26-18(23-24-19(27)15-9-3-1-4-10-15)13-5-2-8-14-25-20(28)16-11-6-7-12-17(16)22-21(25)29/h1,3-4,6-7,9-12H,2,5,8,13-14H2,(H,22,29)(H,23,26)(H,24,27)