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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4S/c1-17-3-5-18(6-4-17)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+