ethyl 5-(4-methylsulfanylphenyl)-3-oxidanylidene-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-(4-methylsulfanylphenyl)-3-oxidanylidene-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-methylsulfanylphenyl)-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 5-[4-(methylthio)phenyl]-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methylsulfanylphenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 3-keto-5-[4-(methylthio)phenyl]-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)CS2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)CS2)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S2/c1-3-27-21(26)18-19(14-7-5-4-6-8-14)23-22-24(17(25)13-29-22)20(18)15-9-11-16(28-2)12-10-15/h4-12,20H,3,13H2,1-2H3