(E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(2-thenoyl)acrylonitrile Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=C(C#N)C(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=C(\C#N)/C(=O)C2=CC=CS2

InChI

InChI=1S/C17H18N2OS/c1-11(2)19-12(3)8-14(13(19)4)9-15(10-18)17(20)16-6-5-7-21-16/h5-9,11H,1-4H3/b15-9+