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

Systemtic Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-3-p-cumenyl-acrylamide Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H26N2O5S/c1-18(2)20-8-5-19(6-9-20)7-12-26(29)28-16-25(21-4-3-13-27-15-21)34(30,31)22-10-11-23-24(14-22)33-17-32-23/h3-15,18,25H,16-17H2,1-2H3,(H,28,29)/b12-7+