4-[(E)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-pyridin-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-pyridin-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-(2-pyridyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-(4-ethyl-3,5-dimethyl-2-pyrrolylidene)methyl]-5-(2-pyridinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-(4-ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]-5-pyridin-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-(2-pyridyl)-3-pyrazolin-3-one Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC2=C(NNC2=O)C3=CC=CC=N3)N=C1C)C

Isomeric SMILES

CCC1=C(/C(=C\C2=C(NNC2=O)C3=CC=CC=N3)/N=C1C)C

InChI

InChI=1S/C17H18N4O/c1-4-12-10(2)15(19-11(12)3)9-13-16(20-21-17(13)22)14-7-5-6-8-18-14/h5-9H,4H2,1-3H3,(H2,20,21,22)/b15-9+