1-(2-adamantyl)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-(2-adamantyl)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-(2-adamantyl)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-(2-adamantyl)-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-(2-adamantyl)-4-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(2-adamantyl)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-piperazine Formula: C25H34N4O2S MolecularWeight: 454.62806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C25H34N4O2S/c1-17-25(18(2)29(26-17)23-6-4-3-5-7-23)32(30,31)28-10-8-27(9-11-28)24-21-13-19-12-20(15-21)16-22(24)14-19/h3-7,19-22,24H,8-16H2,1-2H3