(E)-3-(2,4-dimethoxyphenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,4-dimethoxyphenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(2,4-dimethoxyphenyl)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2,4-dimethoxyphenyl)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2,4-dimethoxyphenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(2,4-dimethoxyphenyl)-1-[4-(2-naphthylsulfonyl)piperazino]prop-2-en-1-one Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C25H26N2O5S/c1-31-22-10-7-20(24(18-22)32-2)9-12-25(28)26-13-15-27(16-14-26)33(29,30)23-11-8-19-5-3-4-6-21(19)17-23/h3-12,17-18H,13-16H2,1-2H3/b12-9+