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

Systemtic Name: 5-chloranyl-2-methoxy-N'-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Openeye Name: 5-chloro-2-methoxy-N'-[6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoyl]benzohydrazide CAS Name: 5-chloro-2-methoxy-N'-[1-oxo-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexyl]benzohydrazide IUPAC Name: 5-chloro-2-methoxy-N'-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]benzohydrazide Traditional Name: 5-chloro-N'-[6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoyl]-2-methoxy-benzohydrazide Formula: C22H23ClN4O4S MolecularWeight: 474.96042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C22H23ClN4O4S/c1-31-18-11-10-14(23)13-16(18)20(29)26-25-19(28)9-3-2-6-12-27-21(30)15-7-4-5-8-17(15)24-22(27)32/h4-5,7-8,10-11,13H,2-3,6,9,12H2,1H3,(H,24,32)(H,25,28)(H,26,29)