1-[2-(2-methylpropyl)-4-propan-2-ylsulfonyl-phenyl]-3-(phenylmethyl)piperazine

Systemtic Name: 1-[2-(2-methylpropyl)-4-propan-2-ylsulfonyl-phenyl]-3-(phenylmethyl)piperazine Openeye Name: 3-benzyl-1-(2-isobutyl-4-isopropylsulfonyl-phenyl)piperazine CAS Name: 1-[2-(2-methylpropyl)-4-propan-2-ylsulfonylphenyl]-3-(phenylmethyl)piperazine IUPAC Name: 3-benzyl-1-[2-(2-methylpropyl)-4-propan-2-ylsulfonylphenyl]piperazine Traditional Name: 3-benzyl-1-(2-isobutyl-4-isopropylsulfonyl-phenyl)piperazine Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)CC3=CC=CC=C3

InChI

InChI=1S/C24H34N2O2S/c1-18(2)14-21-16-23(29(27,28)19(3)4)10-11-24(21)26-13-12-25-22(17-26)15-20-8-6-5-7-9-20/h5-11,16,18-19,22,25H,12-15,17H2,1-4H3