methyl 4-(4,5-diphenyl-1,3-thiazol-2-yl)-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(4,5-diphenyl-1,3-thiazol-2-yl)-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-(4,5-diphenylthiazol-2-yl)-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-(4,5-diphenyl-2-thiazolyl)-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4,5-diphenyl-1,3-thiazol-2-yl)-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-(4,5-diphenylthiazol-2-yl)-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C22H17NO2S3 MolecularWeight: 423.57088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17NO2S3/c1-25-21(24)17-13-16(22(26-2)27-17)20-23-18(14-9-5-3-6-10-14)19(28-20)15-11-7-4-8-12-15/h3-13H,1-2H3