3-[1,3-benzoxazol-2-yl-(4,6-dimethylpyrimidin-2-yl)amino]propanenitrile

Systemtic Name: 3-[1,3-benzoxazol-2-yl-(4,6-dimethylpyrimidin-2-yl)amino]propanenitrile Openeye Name: 3-[1,3-benzoxazol-2-yl-(4,6-dimethylpyrimidin-2-yl)amino]propanenitrile CAS Name: 3-[1,3-benzoxazol-2-yl-(4,6-dimethyl-2-pyrimidinyl)amino]propanenitrile IUPAC Name: 3-[1,3-benzoxazol-2-yl-(4,6-dimethylpyrimidin-2-yl)amino]propanenitrile Traditional Name: 3-[1,3-benzoxazol-2-yl-(4,6-dimethylpyrimidin-2-yl)amino]propionitrile Formula: C16H15N5O MolecularWeight: 293.3232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N(CCC#N)C2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=NC(=N1)N(CCC#N)C2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C16H15N5O/c1-11-10-12(2)19-15(18-11)21(9-5-8-17)16-20-13-6-3-4-7-14(13)22-16/h3-4,6-7,10H,5,9H2,1-2H3