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

Systemtic Name: 1-[2-ethyl-4-(phenylmethyl)phenyl]-3-propan-2-ylsulfonyl-piperazine Openeye Name: 1-(4-benzyl-2-ethyl-phenyl)-3-isopropylsulfonyl-piperazine CAS Name: 1-[2-ethyl-4-(phenylmethyl)phenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-(4-benzyl-2-ethylphenyl)-3-propan-2-ylsulfonylpiperazine Traditional Name: 1-(4-benzyl-2-ethyl-phenyl)-3-isopropylsulfonyl-piperazine Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H30N2O2S/c1-4-20-15-19(14-18-8-6-5-7-9-18)10-11-21(20)24-13-12-23-22(16-24)27(25,26)17(2)3/h5-11,15,17,22-23H,4,12-14,16H2,1-3H3