methyl 3-azanyl-4-(4-methylphenyl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-(4-methylphenyl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 3-amino-5-methylsulfanyl-4-(p-tolylsulfonyl)thiophene-2-carboxylate CAS Name: 3-amino-4-(4-methylphenyl)sulfonyl-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-(4-methylphenyl)sulfonyl-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-amino-5-(methylthio)-4-tosyl-thiophene-2-carboxylic acid methyl ester Formula: C14H15NO4S3 MolecularWeight: 357.4682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)OC)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)OC)SC

InChI

InChI=1S/C14H15NO4S3/c1-8-4-6-9(7-5-8)22(17,18)12-10(15)11(13(16)19-2)21-14(12)20-3/h4-7H,15H2,1-3H3