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

Systemtic Name: 4-(4-oxidanylidene-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-[4-oxo-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]butanamide CAS Name: 4-[4-oxo-7-(3-pyridinyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(4-oxo-7-pyridin-3-yl-1H-pyrrolo[3,2-d]pyrimidin-5-yl)butanamide Traditional Name: N-benzyl-4-[4-keto-7-(3-pyridyl)-1H-pyrrolo[3,2-d]pyrimidin-5-yl]butyramide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCN2C=C(C3=C2C(=O)N=CN3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCN2C=C(C3=C2C(=O)N=CN3)C4=CN=CC=C4

InChI

InChI=1S/C22H21N5O2/c28-19(24-12-16-6-2-1-3-7-16)9-5-11-27-14-18(17-8-4-10-23-13-17)20-21(27)22(29)26-15-25-20/h1-4,6-8,10,13-15H,5,9,11-12H2,(H,24,28)(H,25,26,29)