[4-(diphenylmethyl)piperazin-1-yl]-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-[6-(1-methylpyrazol-4-yl)-3-pyridyl]methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-[6-(1-methyl-4-pyrazolyl)-3-pyridinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]methanone Traditional Name: (4-benzhydrylpiperazino)-[6-(1-methylpyrazol-4-yl)-3-pyridyl]methanone Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC=C(C=C2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C=C(C=N1)C2=NC=C(C=C2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O/c1-30-20-24(19-29-30)25-13-12-23(18-28-25)27(33)32-16-14-31(15-17-32)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18-20,26H,14-17H2,1H3