(E)-N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-3-p-cumenyl-acrylamide Formula: C25H25NO5S2 MolecularWeight: 483.5997

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NCC(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO5S2/c1-17(2)19-8-5-18(6-9-19)7-12-24(27)26-15-23(33(28,29)25-4-3-13-32-25)20-10-11-21-22(14-20)31-16-30-21/h3-14,17,23H,15-16H2,1-2H3,(H,26,27)/b12-7+