3-methoxy-N'-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]-4-propoxy-benzohydrazide

Systemtic Name: 3-methoxy-N'-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]-4-propoxy-benzohydrazide Openeye Name: 3-methoxy-N'-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoyl]-4-propoxy-benzohydrazide CAS Name: 3-methoxy-N'-[1-oxo-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]-4-propoxybenzohydrazide IUPAC Name: 3-methoxy-N'-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]-4-propoxybenzohydrazide Traditional Name: N'-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propanoyl]-3-methoxy-4-propoxy-benzohydrazide Formula: C22H24N4O5S MolecularWeight: 456.51476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)OC

InChI

InChI=1S/C22H24N4O5S/c1-3-12-31-17-9-8-14(13-18(17)30-2)20(28)25-24-19(27)10-11-26-21(29)15-6-4-5-7-16(15)23-22(26)32/h4-9,13H,3,10-12H2,1-2H3,(H,23,32)(H,24,27)(H,25,28)