N-[[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-chloranyl-phenyl]methyl]-3-(2-methylpiperidin-1-yl)propan-1-amine

Systemtic Name: N-[[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-chloranyl-phenyl]methyl]-3-(2-methylpiperidin-1-yl)propan-1-amine Openeye Name: N-[[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-chloro-phenyl]methyl]-3-(2-methyl-1-piperidyl)propan-1-amine CAS Name: N-[[2-[(5-bromo-2-methoxyphenyl)methylthio]-3-chlorophenyl]methyl]-3-(2-methyl-1-piperidinyl)-1-propanamine IUPAC Name: N-[[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-chlorophenyl]methyl]-3-(2-methylpiperidin-1-yl)propan-1-amine Traditional Name: [2-[(5-bromo-2-methoxy-benzyl)thio]-3-chloro-benzyl]-[3-(2-methylpiperidino)propyl]amine Formula: C24H32BrClN2OS MolecularWeight: 511.94568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNCC2=C(C(=CC=C2)Cl)SCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1CCCCN1CCCNCC2=C(C(=CC=C2)Cl)SCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C24H32BrClN2OS/c1-18-7-3-4-13-28(18)14-6-12-27-16-19-8-5-9-22(26)24(19)30-17-20-15-21(25)10-11-23(20)29-2/h5,8-11,15,18,27H,3-4,6-7,12-14,16-17H2,1-2H3