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

Systemtic Name: (E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-tosyl-acrylonitrile Formula: C22H20N2O2S MolecularWeight: 376.4714

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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)C3=CC=CC=C3)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=C(N(C(=C2)C)C3=CC=CC=C3)C)/C#N

InChI

InChI=1S/C22H20N2O2S/c1-16-9-11-21(12-10-16)27(25,26)22(15-23)14-19-13-17(2)24(18(19)3)20-7-5-4-6-8-20/h4-14H,1-3H3/b22-14+