3-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-3-oxo-propanenitrile CAS Name: 3-[3-(2,5-dimethyl-1-pyrrolyl)-2-thiophenyl]-3-oxopropanenitrile IUPAC Name: 3-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-3-oxopropanenitrile Traditional Name: 3-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-3-keto-propionitrile Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(SC=C2)C(=O)CC#N)C

Isomeric SMILES

CC1=CC=C(N1C2=C(SC=C2)C(=O)CC#N)C

InChI

InChI=1S/C13H12N2OS/c1-9-3-4-10(2)15(9)11-6-8-17-13(11)12(16)5-7-14/h3-4,6,8H,5H2,1-2H3