(E)-3-(2-methoxy-5-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-methoxy-5-methyl-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(2-methoxy-5-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2-methoxy-5-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-besylpiperazino)-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4S/c1-17-8-10-20(27-2)18(16-17)9-11-21(24)22-12-14-23(15-13-22)28(25,26)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3/b11-9+