N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-chlorophenyl)-2-[4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-2-[4-[4-(methylthio)benzyl]piperazino]acetamide Formula: C20H23BrClN3OS MolecularWeight: 468.83812

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C20H23BrClN3OS/c1-27-17-5-2-15(3-6-17)13-24-8-10-25(11-9-24)14-20(26)23-19-7-4-16(21)12-18(19)22/h2-7,12H,8-11,13-14H2,1H3,(H,23,26)