ethyl 2,4-dimethyl-5-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-(5-thiophen-2-yl-2-tetrazolyl)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2N=C(N=N2)C3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2N=C(N=N2)C3=CC=CS3)C

InChI

InChI=1S/C16H17N5O3S/c1-4-24-16(23)13-9(2)14(17-10(13)3)11(22)8-21-19-15(18-20-21)12-6-5-7-25-12/h5-7,17H,4,8H2,1-3H3