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

Systemtic Name: diethyl 3-methyl-5-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(1-methyl-5-tetrazolyl)thio]methyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[(1-methyltetrazol-5-yl)thio]methyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C14H19N5O4S MolecularWeight: 353.39676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CSC2=NN=NN2C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CSC2=NN=NN2C

InChI

InChI=1S/C14H19N5O4S/c1-5-22-12(20)10-8(3)11(13(21)23-6-2)15-9(10)7-24-14-16-17-18-19(14)4/h15H,5-7H2,1-4H3