1-(1-adamantyl)-4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyl-piperazine Openeye Name: 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyl-piperazine CAS Name: 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethyl-phenyl)sulfonyl-piperazine Formula: C23H34N2O3S MolecularWeight: 418.59266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C23H34N2O3S/c1-16-8-21(28-3)22(9-17(16)2)29(26,27)25-6-4-24(5-7-25)23-13-18-10-19(14-23)12-20(11-18)15-23/h8-9,18-20H,4-7,10-15H2,1-3H3