2-[(1,3-dimethyl-2-oxidanylidene-perimidin-6-yl)methylidene]propanedinitrile

Systemtic Name: 2-[(1,3-dimethyl-2-oxidanylidene-perimidin-6-yl)methylidene]propanedinitrile Openeye Name: 2-[(1,3-dimethyl-2-oxo-perimidin-6-yl)methylene]propanedinitrile CAS Name: 2-[(1,3-dimethyl-2-oxo-6-perimidinyl)methylidene]propanedinitrile IUPAC Name: 2-[(1,3-dimethyl-2-oxoperimidin-6-yl)methylidene]propanedinitrile Traditional Name: 2-[(2-keto-1,3-dimethyl-perimidin-6-yl)methylene]malononitrile Formula: C17H12N4O MolecularWeight: 288.30338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C3C(=C(C=C2)C=C(C#N)C#N)C=CC=C3N(C1=O)C

Isomeric SMILES

CN1C2=C3C(=C(C=C2)C=C(C#N)C#N)C=CC=C3N(C1=O)C

InChI

InChI=1S/C17H12N4O/c1-20-14-5-3-4-13-12(8-11(9-18)10-19)6-7-15(16(13)14)21(2)17(20)22/h3-8H,1-2H3