2-(1,3-benzoxazol-2-yl)-2-(6-methyl-2-piperidin-1-yl-pyrimidin-4-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-2-(6-methyl-2-piperidin-1-yl-pyrimidin-4-yl)ethanenitrile Openeye Name: 2-(1,3-benzoxazol-2-yl)-2-[6-methyl-2-(1-piperidyl)pyrimidin-4-yl]acetonitrile CAS Name: 2-(1,3-benzoxazol-2-yl)-2-[6-methyl-2-(1-piperidinyl)-4-pyrimidinyl]acetonitrile IUPAC Name: 2-(1,3-benzoxazol-2-yl)-2-(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)acetonitrile Traditional Name: 2-(1,3-benzoxazol-2-yl)-2-(6-methyl-2-piperidino-pyrimidin-4-yl)acetonitrile Formula: C19H19N5O MolecularWeight: 333.38706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCCCC2)C(C#N)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCCCC2)C(C#N)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H19N5O/c1-13-11-16(23-19(21-13)24-9-5-2-6-10-24)14(12-20)18-22-15-7-3-4-8-17(15)25-18/h3-4,7-8,11,14H,2,5-6,9-10H2,1H3