2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-1-[4-(2-hydroxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-1-[4-(2-hydroxyethyl)piperazino]ethanone Formula: C15H21BrN2O2S MolecularWeight: 373.30844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)N2CCN(CC2)CCO

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)N2CCN(CC2)CCO

InChI

InChI=1S/C15H21BrN2O2S/c1-12-10-13(16)2-3-14(12)21-11-15(20)18-6-4-17(5-7-18)8-9-19/h2-3,10,19H,4-9,11H2,1H3