4-chloranyl-1-ethyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-1-ethyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Openeye Name: 4-chloro-1-ethyl-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide CAS Name: 4-chloro-1-ethyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-pyrazolecarboxamide IUPAC Name: 4-chloro-1-ethyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Traditional Name: 4-chloro-1-ethyl-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide Formula: C14H12ClN5O2S MolecularWeight: 349.79538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)Cl

InChI

InChI=1S/C14H12ClN5O2S/c1-2-19-7-9(15)11(17-19)12(21)18-20-13(22)8-5-3-4-6-10(8)16-14(20)23/h3-7H,2H2,1H3,(H,16,23)(H,18,21)