methyl 4-(2,3-dihydro-1H-inden-5-ylamino)-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(2,3-dihydro-1H-inden-5-ylamino)-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 4-(indan-5-ylamino)-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 4-(2,3-dihydro-1H-inden-5-ylamino)-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2,3-dihydro-1H-inden-5-ylamino)-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 4-(indan-5-ylamino)-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C16H17NO2S2 MolecularWeight: 319.44168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C16H17NO2S2/c1-19-15(18)14-9-13(16(20-2)21-14)17-12-7-6-10-4-3-5-11(10)8-12/h6-9,17H,3-5H2,1-2H3