(3S)-2-azanylidene-3-(2,5-dimethylpyrrol-1-yl)butanedinitrile

Systemtic Name: (3S)-2-azanylidene-3-(2,5-dimethylpyrrol-1-yl)butanedinitrile Openeye Name: (2S)-2-cyano-2-(2,5-dimethylpyrrol-1-yl)acetimidoyl cyanide CAS Name: (2S)-2-(2,5-dimethyl-1-pyrrolyl)-3-iminobutanedinitrile IUPAC Name: (2S)-2-cyano-2-(2,5-dimethylpyrrol-1-yl)ethanimidoyl cyanide Traditional Name: (2S)-2-(2,5-dimethylpyrrol-1-yl)-3-imino-succinonitrile Formula: C10H10N4 MolecularWeight: 186.2132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C(C#N)C(=N)C#N)C

Isomeric SMILES

CC1=CC=C(N1[C@H](C#N)C(=N)C#N)C

InChI

InChI=1S/C10H10N4/c1-7-3-4-8(2)14(7)10(6-12)9(13)5-11/h3-4,10,13H,1-2H3/t10-/m1/s1