(4-imidazol-1-ylphenyl)-[(3S)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone

Systemtic Name: (4-imidazol-1-ylphenyl)-[(3S)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone Openeye Name: (4-imidazol-1-ylphenyl)-[(3S)-3-[4-(o-tolyl)-1H-pyrazol-5-yl]-1-piperidyl]methanone CAS Name: [4-(1-imidazolyl)phenyl]-[(3S)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]-1-piperidinyl]methanone IUPAC Name: (4-imidazol-1-ylphenyl)-[(3S)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone Traditional Name: (4-imidazol-1-ylphenyl)-[(3S)-3-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidino]methanone Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(NN=C2)C3CCCN(C3)C(=O)C4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

CC1=CC=CC=C1C2=C(NN=C2)[C@H]3CCCN(C3)C(=O)C4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C25H25N5O/c1-18-5-2-3-7-22(18)23-15-27-28-24(23)20-6-4-13-29(16-20)25(31)19-8-10-21(11-9-19)30-14-12-26-17-30/h2-3,5,7-12,14-15,17,20H,4,6,13,16H2,1H3,(H,27,28)/t20-/m0/s1