[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: [3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: [3-(1-adamantyl)-1-phenyl-4-pyrazolyl]-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [3-(1-adamantyl)-1-phenylpyrazol-4-yl]-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-(4-m-anisylpiperazino)methanone Formula: C32H38N4O2 MolecularWeight: 510.66972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CC2)C(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CC2)C(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C32H38N4O2/c1-38-28-9-5-6-23(17-28)21-34-10-12-35(13-11-34)31(37)29-22-36(27-7-3-2-4-8-27)33-30(29)32-18-24-14-25(19-32)16-26(15-24)20-32/h2-9,17,22,24-26H,10-16,18-21H2,1H3