1-[(2-bromanyl-4,5-dimethoxy-phenyl)-thiophen-3-yl-methyl]piperazine

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-thiophen-3-yl-methyl]piperazine Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(3-thienyl)methyl]piperazine CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(3-thiophenyl)methyl]piperazine IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-thiophen-3-ylmethyl]piperazine Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(3-thienyl)methyl]piperazine Formula: C17H21BrN2O2S MolecularWeight: 397.32984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C2=CSC=C2)N3CCNCC3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C2=CSC=C2)N3CCNCC3)Br)OC

InChI

InChI=1S/C17H21BrN2O2S/c1-21-15-9-13(14(18)10-16(15)22-2)17(12-3-8-23-11-12)20-6-4-19-5-7-20/h3,8-11,17,19H,4-7H2,1-2H3