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

Systemtic Name: 4-[(E)-[4-(2-diethylaminoethyl)-5-methyl-3-pyridin-2-yl-pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-[4-(2-diethylaminoethyl)-5-methyl-3-(2-pyridyl)pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-[4-(2-diethylaminoethyl)-5-methyl-3-(2-pyridinyl)-2-pyrrolylidene]methyl]-5-(2-pyrazinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-[4-(2-diethylaminoethyl)-5-methyl-3-pyridin-2-ylpyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-[4-(2-diethylaminoethyl)-5-methyl-3-(2-pyridyl)pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-3-pyrazolin-3-one Formula: C24H27N7O MolecularWeight: 429.51748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=C(C(=CC2=C(NNC2=O)C3=NC=CN=C3)N=C1C)C4=CC=CC=N4

Isomeric SMILES

CCN(CC)CCC1=C(/C(=C\C2=C(NNC2=O)C3=NC=CN=C3)/N=C1C)C4=CC=CC=N4

InChI

InChI=1S/C24H27N7O/c1-4-31(5-2)13-9-17-16(3)28-20(22(17)19-8-6-7-10-26-19)14-18-23(29-30-24(18)32)21-15-25-11-12-27-21/h6-8,10-12,14-15H,4-5,9,13H2,1-3H3,(H2,29,30,32)/b20-14+