2-[4-(3-azanylpiperidin-1-yl)-1-methyl-6-oxidanylidene-2-phenyl-pyrimidin-5-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[4-(3-azanylpiperidin-1-yl)-1-methyl-6-oxidanylidene-2-phenyl-pyrimidin-5-yl]oxybenzenecarbonitrile Openeye Name: 2-[4-(3-amino-1-piperidyl)-1-methyl-6-oxo-2-phenyl-pyrimidin-5-yl]oxybenzonitrile CAS Name: 2-[[4-(3-amino-1-piperidinyl)-1-methyl-6-oxo-2-phenyl-5-pyrimidinyl]oxy]benzonitrile IUPAC Name: 2-[4-(3-aminopiperidin-1-yl)-1-methyl-6-oxo-2-phenylpyrimidin-5-yl]oxybenzonitrile Traditional Name: 2-[4-(3-aminopiperidino)-6-keto-1-methyl-2-phenyl-pyrimidin-5-yl]oxybenzonitrile Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=C(C1=O)OC2=CC=CC=C2C#N)N3CCCC(C3)N)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NC(=C(C1=O)OC2=CC=CC=C2C#N)N3CCCC(C3)N)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2/c1-27-21(16-8-3-2-4-9-16)26-22(28-13-7-11-18(25)15-28)20(23(27)29)30-19-12-6-5-10-17(19)14-24/h2-6,8-10,12,18H,7,11,13,15,25H2,1H3