2-[4-azanyl-2,6-bis(oxidanylidene)-5-piperidin-1-yl-3-propyl-pyrimidin-1-yl]-N-(5-chloranyl-2-cyano-phenyl)ethanamide

Systemtic Name: 2-[4-azanyl-2,6-bis(oxidanylidene)-5-piperidin-1-yl-3-propyl-pyrimidin-1-yl]-N-(5-chloranyl-2-cyano-phenyl)ethanamide Openeye Name: 2-[4-amino-2,6-dioxo-5-(1-piperidyl)-3-propyl-pyrimidin-1-yl]-N-(5-chloro-2-cyano-phenyl)acetamide CAS Name: 2-[4-amino-2,6-dioxo-5-(1-piperidinyl)-3-propyl-1-pyrimidinyl]-N-(5-chloro-2-cyanophenyl)acetamide IUPAC Name: 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-(5-chloro-2-cyanophenyl)acetamide Traditional Name: 2-(4-amino-2,6-diketo-5-piperidino-3-propyl-pyrimidin-1-yl)-N-(5-chloro-2-cyano-phenyl)acetamide Formula: C21H25ClN6O3 MolecularWeight: 444.9146

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CC(=O)NC2=C(C=CC(=C2)Cl)C#N)N3CCCCC3)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CC(=O)NC2=C(C=CC(=C2)Cl)C#N)N3CCCCC3)N

InChI

InChI=1S/C21H25ClN6O3/c1-2-8-27-19(24)18(26-9-4-3-5-10-26)20(30)28(21(27)31)13-17(29)25-16-11-15(22)7-6-14(16)12-23/h6-7,11H,2-5,8-10,13,24H2,1H3,(H,25,29)