2-[7-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-8-yl]propanenitrile

Systemtic Name: 2-[7-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-8-yl]propanenitrile Openeye Name: 2-[7-oxo-2-[4-(1-piperidyl)anilino]pyrido[2,3-d]pyrimidin-8-yl]propanenitrile CAS Name: 2-[7-oxo-2-[4-(1-piperidinyl)anilino]-8-pyrido[2,3-d]pyrimidinyl]propanenitrile IUPAC Name: 2-[7-oxo-2-(4-piperidin-1-ylanilino)pyrido[2,3-d]pyrimidin-8-yl]propanenitrile Traditional Name: 2-[7-keto-2-(4-piperidinoanilino)pyrido[2,3-d]pyrimidin-8-yl]propionitrile Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N1C(=O)C=CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC(C#N)N1C(=O)C=CC2=CN=C(N=C21)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C21H22N6O/c1-15(13-22)27-19(28)10-5-16-14-23-21(25-20(16)27)24-17-6-8-18(9-7-17)26-11-3-2-4-12-26/h5-10,14-15H,2-4,11-12H2,1H3,(H,23,24,25)