3-(cyclohexylcarbamoyl)-5-oxidanylidene-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate

Systemtic Name: 3-(cyclohexylcarbamoyl)-5-oxidanylidene-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Openeye Name: 3-(cyclohexylcarbamoyl)-5-oxo-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylate CAS Name: 3-[(cyclohexylamino)-oxomethyl]-5-oxo-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-8-carboxylate IUPAC Name: 3-(cyclohexylcarbamoyl)-5-oxo-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Traditional Name: 3-(cyclohexylcarbamoyl)-5-keto-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylate Formula: C18H16N3O4S2- MolecularWeight: 402.46734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C3NC(=O)C4=C(N3C(=S)S2)C=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C18H17N3O4S2/c22-15-11-7-6-9(17(24)25)8-12(11)21-14(20-15)13(27-18(21)26)16(23)19-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,19,23)(H,20,22)(H,24,25)/p-1