3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-methyl]-N-methyl-aniline

Systemtic Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-methyl]-N-methyl-aniline Openeye Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-methyl]-N-methyl-aniline CAS Name: 3-[[1-[bis(4-chlorophenyl)methyl]-3-azetidinyl]-methylsulfonylmethyl]-N-methylaniline IUPAC Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonylmethyl]-N-methylaniline Traditional Name: [3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-mesyl-methyl]phenyl]-methyl-amine Formula: C25H26Cl2N2O2S MolecularWeight: 489.45714

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC(=C1)C(C2CN(C2)C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)S(=O)(=O)C

Isomeric SMILES

CNC1=CC=CC(=C1)C(C2CN(C2)C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C25H26Cl2N2O2S/c1-28-23-5-3-4-19(14-23)25(32(2,30)31)20-15-29(16-20)24(17-6-10-21(26)11-7-17)18-8-12-22(27)13-9-18/h3-14,20,24-25,28H,15-16H2,1-2H3