(E)-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-[2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)-2-tosyl-acrylonitrile Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(N(C(=C2)C)CC(C)C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=C(N(C(=C2)C)CC(C)C)C)/C#N

InChI

InChI=1S/C20H24N2O2S/c1-14(2)13-22-16(4)10-18(17(22)5)11-20(12-21)25(23,24)19-8-6-15(3)7-9-19/h6-11,14H,13H2,1-5H3/b20-11+