4-chloranyl-2-[[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methylamino]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methylamino]benzenecarbonitrile Openeye Name: 4-chloro-2-[(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)methylamino]benzonitrile CAS Name: 4-chloro-2-[(1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)methylamino]benzonitrile IUPAC Name: 4-chloro-2-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methylamino]benzonitrile Traditional Name: 4-chloro-2-[(2,4-diketo-1,3-dimethyl-pyrimidin-5-yl)methylamino]benzonitrile Formula: C14H13ClN4O2 MolecularWeight: 304.73162

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)CNC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)CNC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C14H13ClN4O2/c1-18-8-10(13(20)19(2)14(18)21)7-17-12-5-11(15)4-3-9(12)6-16/h3-5,8,17H,7H2,1-2H3