[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-[4-(2-pyridyl)piperazino]methanone Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=N4)C

InChI

InChI=1S/C21H23N5O/c1-15-6-7-17(13-16(15)2)18-14-19(24-23-18)21(27)26-11-9-25(10-12-26)20-5-3-4-8-22-20/h3-8,13-14H,9-12H2,1-2H3,(H,23,24)