1-[2-[2-[(4-bromanyl-2-methyl-phenoxy)methyl]-1-benzothiophen-3-yl]ethyl]-N,N-dimethyl-piperidin-4-amine

Systemtic Name: 1-[2-[2-[(4-bromanyl-2-methyl-phenoxy)methyl]-1-benzothiophen-3-yl]ethyl]-N,N-dimethyl-piperidin-4-amine Openeye Name: 1-[2-[2-[(4-bromo-2-methyl-phenoxy)methyl]benzothiophen-3-yl]ethyl]-N,N-dimethyl-piperidin-4-amine CAS Name: 1-[2-[2-[(4-bromo-2-methylphenoxy)methyl]-1-benzothiophen-3-yl]ethyl]-N,N-dimethyl-4-piperidinamine IUPAC Name: 1-[2-[2-[(4-bromo-2-methylphenoxy)methyl]-1-benzothiophen-3-yl]ethyl]-N,N-dimethylpiperidin-4-amine Traditional Name: [1-[2-[2-[(4-bromo-2-methyl-phenoxy)methyl]benzothiophen-3-yl]ethyl]-4-piperidyl]-dimethyl-amine Formula: C25H31BrN2OS MolecularWeight: 487.49544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC2=C(C3=CC=CC=C3S2)CCN4CCC(CC4)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC2=C(C3=CC=CC=C3S2)CCN4CCC(CC4)N(C)C

InChI

InChI=1S/C25H31BrN2OS/c1-18-16-19(26)8-9-23(18)29-17-25-22(21-6-4-5-7-24(21)30-25)12-15-28-13-10-20(11-14-28)27(2)3/h4-9,16,20H,10-15,17H2,1-3H3