ethyl (5E)-2,4-dimethyl-5-[(3-oxidanylidene-5-pyrazin-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxidanylidene-5-pyrazin-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxo-5-pyrazin-2-yl-1,2-dihydropyrazol-4-yl)methylene]pyrrole-3-carboxylate CAS Name: (5E)-2,4-dimethyl-5-[[3-oxo-5-(2-pyrazinyl)-1,2-dihydropyrazol-4-yl]methylidene]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxo-5-pyrazin-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (5E)-5-[(3-keto-5-pyrazin-2-yl-3-pyrazolin-4-yl)methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC2=C(NNC2=O)C3=NC=CN=C3)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=C\C2=C(NNC2=O)C3=NC=CN=C3)/N=C1C)C

InChI

InChI=1S/C17H17N5O3/c1-4-25-17(24)14-9(2)12(20-10(14)3)7-11-15(21-22-16(11)23)13-8-18-5-6-19-13/h5-8H,4H2,1-3H3,(H2,21,22,23)/b12-7+