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

Systemtic Name: methyl 4-[4-(4-chloranyl-3-methyl-phenyl)-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-[4-(4-chloro-3-methyl-phenyl)thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-[4-(4-chloro-3-methylphenyl)-2-thiazolyl]-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(4-chloro-3-methylphenyl)-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-[4-(4-chloro-3-methyl-phenyl)thiazol-2-yl]-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C17H14ClNO2S3 MolecularWeight: 395.94656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CSC(=N2)C3=C(SC(=C3)C(=O)OC)SC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CSC(=N2)C3=C(SC(=C3)C(=O)OC)SC)Cl

InChI

InChI=1S/C17H14ClNO2S3/c1-9-6-10(4-5-12(9)18)13-8-23-15(19-13)11-7-14(16(20)21-2)24-17(11)22-3/h4-8H,1-3H3