(E)-1-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]prop-2-en-1-one Openeye Name: (E)-1-[2,4-dimethoxy-5-(2-thienyl)phenyl]-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]prop-2-en-1-one CAS Name: (E)-1-(2,4-dimethoxy-5-thiophen-2-ylphenyl)-3-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(2,4-dimethoxy-5-thiophen-2-ylphenyl)-3-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]prop-2-en-1-one Traditional Name: (E)-1-[2,4-dimethoxy-5-(2-thienyl)phenyl]-3-[4-(4-methylpiperazino)sulfonylphenyl]prop-2-en-1-one Formula: C26H28N2O5S2 MolecularWeight: 512.64092

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)C3=C(C=C(C(=C3)C4=CC=CS4)OC)OC

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)C3=C(C=C(C(=C3)C4=CC=CS4)OC)OC

InChI

InChI=1S/C26H28N2O5S2/c1-27-12-14-28(15-13-27)35(30,31)20-9-6-19(7-10-20)8-11-23(29)21-17-22(26-5-4-16-34-26)25(33-3)18-24(21)32-2/h4-11,16-18H,12-15H2,1-3H3/b11-8+