4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(furan-2-yl)-5-methyl-pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(furan-2-yl)-5-methyl-pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(2-furyl)-5-methyl-pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(2-furanyl)-5-methyl-2-pyrrolylidene]methyl]-5-(2-pyrazinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(furan-2-yl)-5-methylpyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-[4-[2-(cyclopropylamino)ethyl]-3-(2-furyl)-5-methyl-pyrrol-2-ylidene]methyl]-5-pyrazin-2-yl-3-pyrazolin-3-one Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=C(NNC2=O)C3=NC=CN=C3)C(=C1CCNC4CC4)C5=CC=CO5

Isomeric SMILES

CC1=N/C(=C/C2=C(NNC2=O)C3=NC=CN=C3)/C(=C1CCNC4CC4)C5=CC=CO5

InChI

InChI=1S/C22H22N6O2/c1-13-15(6-7-24-14-4-5-14)20(19-3-2-10-30-19)17(26-13)11-16-21(27-28-22(16)29)18-12-23-8-9-25-18/h2-3,8-12,14,24H,4-7H2,1H3,(H2,27,28,29)/b17-11+