methyl 4-[(4-chlorophenyl)methyl]-5-oxidanylidene-3-phenyl-1-sulfanylidene-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate

Systemtic Name: methyl 4-[(4-chlorophenyl)methyl]-5-oxidanylidene-3-phenyl-1-sulfanylidene-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Openeye Name: methyl 4-[(4-chlorophenyl)methyl]-5-oxo-3-phenyl-1-thioxo-thiazolo[3,4-a]quinazoline-8-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-8-thiazolo[3,4-a]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Traditional Name: 4-(4-chlorobenzyl)-5-keto-3-phenyl-1-thioxo-thiazolo[3,4-a]quinazoline-8-carboxylic acid methyl ester Formula: C25H17ClN2O3S2 MolecularWeight: 492.99708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C3=C(SC(=S)N23)C4=CC=CC=C4)CC5=CC=C(C=C5)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C3=C(SC(=S)N23)C4=CC=CC=C4)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H17ClN2O3S2/c1-31-24(30)17-9-12-19-20(13-17)28-22(21(33-25(28)32)16-5-3-2-4-6-16)27(23(19)29)14-15-7-10-18(26)11-8-15/h2-13H,14H2,1H3