(E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]acrylamide Formula: C23H21NO6S2 MolecularWeight: 471.54594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C=CC2=CC3=C(C=C2)OCO3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C4=CC=CS4

InChI

InChI=1S/C23H21NO6S2/c1-28-17-6-8-18(9-7-17)32(26,27)22(21-3-2-12-31-21)14-24-23(25)11-5-16-4-10-19-20(13-16)30-15-29-19/h2-13,22H,14-15H2,1H3,(H,24,25)/b11-5+