3-ethyl-4-oxidanylidene-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-4-oxidanylidene-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-4-oxo-N-(3-pyrazin-2-yloxyphenyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-N-[3-(2-pyrazinyloxy)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-4-oxo-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-N-(3-pyrazin-2-yloxyphenyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H17N5O3S MolecularWeight: 419.45638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)OC4=NC=CN=C4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)OC4=NC=CN=C4)NC1=S

InChI

InChI=1S/C21H17N5O3S/c1-2-26-20(28)16-7-6-13(10-17(16)25-21(26)30)19(27)24-14-4-3-5-15(11-14)29-18-12-22-8-9-23-18/h3-12H,2H2,1H3,(H,24,27)(H,25,30)