2-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfanyl-1-(4-prop-2-enylpiperazin-1-yl)ethanone

Systemtic Name: 2-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfanyl-1-(4-prop-2-enylpiperazin-1-yl)ethanone Openeye Name: 1-(4-allylpiperazin-1-yl)-2-(2,4-dichloro-5-methyl-phenyl)sulfanyl-ethanone CAS Name: 2-[(2,4-dichloro-5-methylphenyl)thio]-1-(4-prop-2-enyl-1-piperazinyl)ethanone IUPAC Name: 2-(2,4-dichloro-5-methylphenyl)sulfanyl-1-(4-prop-2-enylpiperazin-1-yl)ethanone Traditional Name: 1-(4-allylpiperazino)-2-[(2,4-dichloro-5-methyl-phenyl)thio]ethanone Formula: C16H20Cl2N2OS MolecularWeight: 359.3138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)Cl)SCC(=O)N2CCN(CC2)CC=C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)Cl)SCC(=O)N2CCN(CC2)CC=C

InChI

InChI=1S/C16H20Cl2N2OS/c1-3-4-19-5-7-20(8-6-19)16(21)11-22-15-9-12(2)13(17)10-14(15)18/h3,9-10H,1,4-8,11H2,2H3