dimethyl 5-azanyl-3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-(indan-5-ylsulfanylmethyl)thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(2,3-dihydro-1H-inden-5-ylthio)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(indan-5-ylthio)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H19NO4S2 MolecularWeight: 377.47776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CSC2=CC3=C(CCC3)C=C2)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CSC2=CC3=C(CCC3)C=C2)C(=O)OC)N

InChI

InChI=1S/C18H19NO4S2/c1-22-17(20)14-13(15(18(21)23-2)25-16(14)19)9-24-12-7-6-10-4-3-5-11(10)8-12/h6-8H,3-5,9,19H2,1-2H3