1-[1-benzothiophen-3-yl-(5-bromanyl-2-methoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[1-benzothiophen-3-yl-(5-bromanyl-2-methoxy-phenyl)methyl]piperazine Openeye Name: 1-[benzothiophen-3-yl-(5-bromo-2-methoxy-phenyl)methyl]piperazine CAS Name: 1-[1-benzothiophen-3-yl-(5-bromo-2-methoxyphenyl)methyl]piperazine IUPAC Name: 1-[1-benzothiophen-3-yl-(5-bromo-2-methoxyphenyl)methyl]piperazine Traditional Name: 1-[benzothiophen-3-yl-(5-bromo-2-methoxy-phenyl)methyl]piperazine Formula: C20H21BrN2OS MolecularWeight: 417.36254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C2=CSC3=CC=CC=C32)N4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C2=CSC3=CC=CC=C32)N4CCNCC4

InChI

InChI=1S/C20H21BrN2OS/c1-24-18-7-6-14(21)12-16(18)20(23-10-8-22-9-11-23)17-13-25-19-5-3-2-4-15(17)19/h2-7,12-13,20,22H,8-11H2,1H3