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

Systemtic Name: 4-[(E)-[4-(diethylaminomethyl)-3,5-dimethyl-pyrrol-2-ylidene]methyl]-5-pyrimidin-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-[4-(diethylaminomethyl)-3,5-dimethyl-pyrrol-2-ylidene]methyl]-5-pyrimidin-2-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-[4-(diethylaminomethyl)-3,5-dimethyl-2-pyrrolylidene]methyl]-5-(2-pyrimidinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-[4-(diethylaminomethyl)-3,5-dimethylpyrrol-2-ylidene]methyl]-5-pyrimidin-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-[4-(diethylaminomethyl)-3,5-dimethyl-pyrrol-2-ylidene]methyl]-5-(2-pyrimidyl)-3-pyrazolin-3-one Formula: C19H24N6O MolecularWeight: 352.43346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC2=C(NNC2=O)C3=NC=CC=N3)N=C1C)C

Isomeric SMILES

CCN(CC)CC1=C(/C(=C\C2=C(NNC2=O)C3=NC=CC=N3)/N=C1C)C

InChI

InChI=1S/C19H24N6O/c1-5-25(6-2)11-15-12(3)16(22-13(15)4)10-14-17(23-24-19(14)26)18-20-8-7-9-21-18/h7-10H,5-6,11H2,1-4H3,(H2,23,24,26)/b16-10+