N-(1,3-benzothiazol-2-yl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(quinazolin-4-ylthio)acetamide Formula: C17H12N4OS2 MolecularWeight: 352.43338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N4OS2/c22-15(21-17-20-13-7-3-4-8-14(13)24-17)9-23-16-11-5-1-2-6-12(11)18-10-19-16/h1-8,10H,9H2,(H,20,21,22)