methyl 4-[4-(2-methylphenyl)-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-[4-(2-methylphenyl)-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfanyl-4-[4-(o-tolyl)thiazol-2-yl]thiophene-2-carboxylate CAS Name: 4-[4-(2-methylphenyl)-2-thiazolyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(2-methylphenyl)-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 5-(methylthio)-4-[4-(o-tolyl)thiazol-2-yl]thiophene-2-carboxylic acid methyl ester Formula: C17H15NO2S3 MolecularWeight: 361.5015

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CSC(=N2)C3=C(SC(=C3)C(=O)OC)SC

Isomeric SMILES

CC1=CC=CC=C1C2=CSC(=N2)C3=C(SC(=C3)C(=O)OC)SC

InChI

InChI=1S/C17H15NO2S3/c1-10-6-4-5-7-11(10)13-9-22-15(18-13)12-8-14(16(19)20-2)23-17(12)21-3/h4-9H,1-3H3