3-(2-azanyl-4-chloranyl-6-phenyl-pyrimidin-5-yl)propanenitrile

Systemtic Name: 3-(2-azanyl-4-chloranyl-6-phenyl-pyrimidin-5-yl)propanenitrile Openeye Name: 3-(2-amino-4-chloro-6-phenyl-pyrimidin-5-yl)propanenitrile CAS Name: 3-(2-amino-4-chloro-6-phenyl-5-pyrimidinyl)propanenitrile IUPAC Name: 3-(2-amino-4-chloro-6-phenylpyrimidin-5-yl)propanenitrile Traditional Name: 3-(2-amino-4-chloro-6-phenyl-pyrimidin-5-yl)propionitrile Formula: C13H11ClN4 MolecularWeight: 258.70624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC(=N2)N)Cl)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC(=N2)N)Cl)CCC#N

InChI

InChI=1S/C13H11ClN4/c14-12-10(7-4-8-15)11(17-13(16)18-12)9-5-2-1-3-6-9/h1-3,5-6H,4,7H2,(H2,16,17,18)