4-[[(Z)-(2-oxidanylidene-1-pyrimidin-2-yl-pyrrolidin-3-ylidene)methyl]amino]benzenecarbonitrile

Systemtic Name: 4-[[(Z)-(2-oxidanylidene-1-pyrimidin-2-yl-pyrrolidin-3-ylidene)methyl]amino]benzenecarbonitrile Openeye Name: 4-[[(Z)-(2-oxo-1-pyrimidin-2-yl-pyrrolidin-3-ylidene)methyl]amino]benzonitrile CAS Name: 4-[[(Z)-[2-oxo-1-(2-pyrimidinyl)-3-pyrrolidinylidene]methyl]amino]benzonitrile IUPAC Name: 4-[[(Z)-(2-oxo-1-pyrimidin-2-ylpyrrolidin-3-ylidene)methyl]amino]benzonitrile Traditional Name: 4-[[(Z)-[2-keto-1-(2-pyrimidyl)pyrrolidin-3-ylidene]methyl]amino]benzonitrile Formula: C16H13N5O MolecularWeight: 291.30732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1=CNC2=CC=C(C=C2)C#N)C3=NC=CC=N3

Isomeric SMILES

C\1CN(C(=O)/C1=C\NC2=CC=C(C=C2)C#N)C3=NC=CC=N3

InChI

InChI=1S/C16H13N5O/c17-10-12-2-4-14(5-3-12)20-11-13-6-9-21(15(13)22)16-18-7-1-8-19-16/h1-5,7-8,11,20H,6,9H2/b13-11-