2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methyl-pyrimidin-4-yl]ethanenitrile

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methyl-pyrimidin-4-yl]ethanenitrile Openeye Name: 2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methyl-pyrimidin-4-yl]acetonitrile CAS Name: 2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methyl-4-pyrimidinyl]acetonitrile IUPAC Name: 2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methylpyrimidin-4-yl]acetonitrile Traditional Name: 2-(1,3-benzoxazol-2-yl)-2-[2-(dipropylamino)-6-methyl-pyrimidin-4-yl]acetonitrile Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=NC(=CC(=N1)C(C#N)C2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CCCN(CCC)C1=NC(=CC(=N1)C(C#N)C2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C20H23N5O/c1-4-10-25(11-5-2)20-22-14(3)12-17(24-20)15(13-21)19-23-16-8-6-7-9-18(16)26-19/h6-9,12,15H,4-5,10-11H2,1-3H3