(E)-3-(3-methylthiophen-2-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-methylthiophen-2-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-methyl-2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(3-methyl-2-thiophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-methylthiophen-2-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-besylpiperazino)-3-(3-methyl-2-thienyl)prop-2-en-1-one Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S2/c1-15-9-14-24-17(15)7-8-18(21)19-10-12-20(13-11-19)25(22,23)16-5-3-2-4-6-16/h2-9,14H,10-13H2,1H3/b8-7+