N-(5-octyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H23N5O2S2 MolecularWeight: 417.54822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

InChI

InChI=1S/C19H23N5O2S2/c1-2-3-4-5-6-7-8-15-23-24-19(28-15)22-16(25)12-9-10-13-14(11-12)20-18(27)21-17(13)26/h9-11H,2-8H2,1H3,(H,22,24,25)(H2,20,21,26,27)