N-(1,3-benzothiazol-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-keto-1H-quinazoline-2-carbothioamide Formula: C16H10N4OS2 MolecularWeight: 338.4068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H10N4OS2/c21-14-9-5-1-2-6-10(9)17-13(19-14)15(22)20-16-18-11-7-3-4-8-12(11)23-16/h1-8H,(H,17,19,21)(H,18,20,22)