dimethyl 5-azanyl-3-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[1-(2-ethoxyphenyl)-5-tetrazolyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(1-o-phenetyltetrazol-5-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H19N5O5S2 MolecularWeight: 449.50396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C18H19N5O5S2/c1-4-28-12-8-6-5-7-11(12)23-18(20-21-22-23)29-9-10-13(16(24)26-2)15(19)30-14(10)17(25)27-3/h5-8H,4,9,19H2,1-3H3