2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)piperazin-1-yl]propan-1-one CAS Name: 2-[(4-bromophenyl)thio]-1-[4-(4-ethylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-[(4-bromophenyl)thio]-1-[4-(4-ethylphenyl)piperazino]propan-1-one Formula: C21H25BrN2OS MolecularWeight: 433.405

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C(C)SC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C(C)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2OS/c1-3-17-4-8-19(9-5-17)23-12-14-24(15-13-23)21(25)16(2)26-20-10-6-18(22)7-11-20/h4-11,16H,3,12-15H2,1-2H3