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

Systemtic Name: diethyl 5-azanyl-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(1-methyl-5-tetrazolyl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(1-methyltetrazol-5-yl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C13H17N5O4S2 MolecularWeight: 371.43518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CSC2=NN=NN2C)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CSC2=NN=NN2C)C(=O)OCC)N

InChI

InChI=1S/C13H17N5O4S2/c1-4-21-11(19)8-7(6-23-13-15-16-17-18(13)3)9(24-10(8)14)12(20)22-5-2/h4-6,14H2,1-3H3