N-(4-dimethylaminophenyl)-2-[(5-oxidanylidene-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-dimethylaminophenyl)-2-[(5-oxidanylidene-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide CAS Name: N-(4-dimethylaminophenyl)-2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)thio]acetamide IUPAC Name: N-(4-dimethylaminophenyl)-2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-keto-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)thio]-N-(4-dimethylaminophenyl)acetamide Formula: C22H22N6O2S MolecularWeight: 434.51408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C22H22N6O2S/c1-4-13-27-20(30)17-7-5-6-8-18(17)28-21(27)24-25-22(28)31-14-19(29)23-15-9-11-16(12-10-15)26(2)3/h4-12H,1,13-14H2,2-3H3,(H,23,29)