ethyl 3-methyl-5-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C16H16N2O2S3 MolecularWeight: 364.50544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC2=NC3=C(S2)C=C(C=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC2=NC3=C(S2)C=C(C=C3)SC)C

InChI

InChI=1S/C16H16N2O2S3/c1-4-20-15(19)14-9(2)7-13(23-14)18-16-17-11-6-5-10(21-3)8-12(11)22-16/h5-8H,4H2,1-3H3,(H,17,18)