(E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-3-(4-benzyloxyphenyl)prop-2-enamide CAS Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-3-(4-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-3-(4-benzoxyphenyl)acrylamide Formula: C30H26N2O6S MolecularWeight: 542.60224

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)/C=C/C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C30H26N2O6S/c33-30(15-10-22-8-11-25(12-9-22)36-20-23-5-2-1-3-6-23)32-19-29(24-7-4-16-31-18-24)39(34,35)26-13-14-27-28(17-26)38-21-37-27/h1-18,29H,19-21H2,(H,32,33)/b15-10+