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

Systemtic Name: 3-(phenylmethyl)-1-[4-(phenylmethyl)-2-propan-2-ylsulfonyl-phenyl]piperazine Openeye Name: 3-benzyl-1-(4-benzyl-2-isopropylsulfonyl-phenyl)piperazine CAS Name: 3-(phenylmethyl)-1-[4-(phenylmethyl)-2-propan-2-ylsulfonylphenyl]piperazine IUPAC Name: 3-benzyl-1-(4-benzyl-2-propan-2-ylsulfonylphenyl)piperazine Traditional Name: 3-benzyl-1-(4-benzyl-2-isopropylsulfonyl-phenyl)piperazine Formula: C27H32N2O2S MolecularWeight: 448.62018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2S/c1-21(2)32(30,31)27-19-24(17-22-9-5-3-6-10-22)13-14-26(27)29-16-15-28-25(20-29)18-23-11-7-4-8-12-23/h3-14,19,21,25,28H,15-18,20H2,1-2H3