ethyl 2,4-dimethyl-5-(1H-1,2,4-triazol-5-ylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-(1H-1,2,4-triazol-5-ylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-(1H-1,2,4-triazol-5-ylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(1H-1,2,4-triazol-5-ylamino)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-(1H-1,2,4-triazol-5-ylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(1H-1,2,4-triazol-5-ylcarbamoyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C12H15N5O3 MolecularWeight: 277.2792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=NC=NN2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=NC=NN2)C

InChI

InChI=1S/C12H15N5O3/c1-4-20-11(19)8-6(2)9(15-7(8)3)10(18)16-12-13-5-14-17-12/h5,15H,4H2,1-3H3,(H2,13,14,16,17,18)