(E)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(2-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(2-methylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(o-tolyl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-3-(2-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(2-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-methoxyphenyl)sulfonylpiperazino]-3-(o-tolyl)prop-2-en-1-one Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4S/c1-17-5-3-4-6-18(17)7-12-21(24)22-13-15-23(16-14-22)28(25,26)20-10-8-19(27-2)9-11-20/h3-12H,13-16H2,1-2H3/b12-7+