4-oxidanylidene-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide

Systemtic Name: 4-oxidanylidene-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide Openeye Name: 4-oxo-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide CAS Name: 4-oxo-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide IUPAC Name: 4-oxo-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-1H-quinazoline-2-carbothioamide Formula: C11H7N5OS3 MolecularWeight: 321.40118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NNC(=S)S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NNC(=S)S3

InChI

InChI=1S/C11H7N5OS3/c17-8-5-3-1-2-4-6(5)12-7(13-8)9(18)14-10-15-16-11(19)20-10/h1-4H,(H,16,19)(H,12,13,17)(H,14,15,18)