4-(6-chloranyl-4-oxidanylidene-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)-N-(cyclohexylmethyl)butanamide

Systemtic Name: 4-(6-chloranyl-4-oxidanylidene-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)-N-(cyclohexylmethyl)butanamide Openeye Name: 4-[6-chloro-4-oxo-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(cyclohexylmethyl)butanamide CAS Name: 4-[6-chloro-4-oxo-7-(3-pyridinyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(cyclohexylmethyl)butanamide IUPAC Name: 4-(6-chloro-4-oxo-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)-N-(cyclohexylmethyl)butanamide Traditional Name: 4-[6-chloro-4-keto-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(cyclohexylmethyl)butyramide Formula: C22H26ClN5O2 MolecularWeight: 427.92714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CCCN2C3=C(C(=C2Cl)C4=CN=CC=C4)NC=NC3=O

Isomeric SMILES

C1CCC(CC1)CNC(=O)CCCN2C3=C(C(=C2Cl)C4=CN=CC=C4)NC=NC3=O

InChI

InChI=1S/C22H26ClN5O2/c23-21-18(16-8-4-10-24-13-16)19-20(22(30)27-14-26-19)28(21)11-5-9-17(29)25-12-15-6-2-1-3-7-15/h4,8,10,13-15H,1-3,5-7,9,11-12H2,(H,25,29)(H,26,27,30)