dimethyl 5-azanyl-3-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[5-oxo-4-(2-thienyl)tetrazol-1-yl]methyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(5-oxo-4-thiophen-2-yl-1-tetrazolyl)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(5-oxo-4-thiophen-2-yltetrazol-1-yl)methyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[5-keto-4-(2-thienyl)tetrazol-1-yl]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H13N5O5S2 MolecularWeight: 395.41352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CN2C(=O)N(N=N2)C3=CC=CS3)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CN2C(=O)N(N=N2)C3=CC=CS3)C(=O)OC)N

InChI

InChI=1S/C14H13N5O5S2/c1-23-12(20)9-7(10(13(21)24-2)26-11(9)15)6-18-14(22)19(17-16-18)8-4-3-5-25-8/h3-5H,6,15H2,1-2H3