4-[(Z)-(3,4-dimethylpyrrol-2-ylidene)methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-(3,4-dimethylpyrrol-2-ylidene)methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-(3,4-dimethylpyrrol-2-ylidene)methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-(3,4-dimethyl-2-pyrrolylidene)methyl]-5-(2-pyrazinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-(3,4-dimethylpyrrol-2-ylidene)methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-(3,4-dimethylpyrrol-2-ylidene)methyl]-5-pyrazin-2-yl-3-pyrazolin-3-one Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(NNC2=O)C3=NC=CN=C3)N=C1)C

Isomeric SMILES

CC1=C(/C(=C/C2=C(NNC2=O)C3=NC=CN=C3)/N=C1)C

InChI

InChI=1S/C14H13N5O/c1-8-6-17-11(9(8)2)5-10-13(18-19-14(10)20)12-7-15-3-4-16-12/h3-7H,1-2H3,(H2,18,19,20)/b11-5-