3-(4-butylsulfanylphenyl)-3-ethylsulfonyl-N,N-dimethyl-3-phenyl-propan-1-amine

Systemtic Name: 3-(4-butylsulfanylphenyl)-3-ethylsulfonyl-N,N-dimethyl-3-phenyl-propan-1-amine Openeye Name: 3-(4-butylsulfanylphenyl)-3-ethylsulfonyl-N,N-dimethyl-3-phenyl-propan-1-amine CAS Name: 3-[4-(butylthio)phenyl]-3-ethylsulfonyl-N,N-dimethyl-3-phenyl-1-propanamine IUPAC Name: 3-(4-butylsulfanylphenyl)-3-ethylsulfonyl-N,N-dimethyl-3-phenylpropan-1-amine Traditional Name: [3-[4-(butylthio)phenyl]-3-esyl-3-phenyl-propyl]-dimethyl-amine Formula: C23H33NO2S2 MolecularWeight: 419.64362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C(CCN(C)C)(C2=CC=CC=C2)S(=O)(=O)CC

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C(CCN(C)C)(C2=CC=CC=C2)S(=O)(=O)CC

InChI

InChI=1S/C23H33NO2S2/c1-5-7-19-27-22-15-13-21(14-16-22)23(17-18-24(3)4,28(25,26)6-2)20-11-9-8-10-12-20/h8-16H,5-7,17-19H2,1-4H3