(E)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-3-(5-methylthiophen-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-3-(5-methylthiophen-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(5-methyl-2-thienyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-3-(5-methyl-2-thiophenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)-3-(5-methylthiophen-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(5-methyl-2-thienyl)acrylonitrile Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=C(C#N)C(=O)C2=C(N(C(=C2)C)CC=C)C

Isomeric SMILES

CC1=CC=C(S1)/C=C(\C#N)/C(=O)C2=C(N(C(=C2)C)CC=C)C

InChI

InChI=1S/C18H18N2OS/c1-5-8-20-12(2)9-17(14(20)4)18(21)15(11-19)10-16-7-6-13(3)22-16/h5-7,9-10H,1,8H2,2-4H3/b15-10+