2-[3-chloranyl-4-(4-methylphenyl)sulfanyl-phenyl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 2-[3-chloranyl-4-(4-methylphenyl)sulfanyl-phenyl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[3-chloro-4-(p-tolylsulfanyl)phenyl]prop-2-en-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[3-chloro-4-[(4-methylphenyl)thio]phenyl]-2-propen-1-one IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[3-chloro-4-(4-methylphenyl)sulfanylphenyl]prop-2-en-1-one Traditional Name: 1-(4-acetylpiperazino)-2-[3-chloro-4-(p-tolylthio)phenyl]prop-2-en-1-one Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=C)C(=O)N3CCN(CC3)C(=O)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=C)C(=O)N3CCN(CC3)C(=O)C)Cl

InChI

InChI=1S/C22H23ClN2O2S/c1-15-4-7-19(8-5-15)28-21-9-6-18(14-20(21)23)16(2)22(27)25-12-10-24(11-13-25)17(3)26/h4-9,14H,2,10-13H2,1,3H3