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

Systemtic Name: diethyl 5-azanyl-3-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(1-cyclopropyl-5-tetrazolyl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(1-cyclopropyltetrazol-5-yl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C15H19N5O4S2 MolecularWeight: 397.47246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CSC2=NN=NN2C3CC3)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CSC2=NN=NN2C3CC3)C(=O)OCC)N

InChI

InChI=1S/C15H19N5O4S2/c1-3-23-13(21)10-9(11(26-12(10)16)14(22)24-4-2)7-25-15-17-18-19-20(15)8-5-6-8/h8H,3-7,16H2,1-2H3