5-[2-[azanyl(iminomethyl)amino]-6-imidazol-1-yl-pyrimidin-4-yl]-N-(phenylmethyl)pentanamide

Systemtic Name: 5-[2-[azanyl(iminomethyl)amino]-6-imidazol-1-yl-pyrimidin-4-yl]-N-(phenylmethyl)pentanamide Openeye Name: 5-[2-[amino(methanimidoyl)amino]-6-imidazol-1-yl-pyrimidin-4-yl]-N-benzyl-pentanamide CAS Name: 5-[2-[amino(methanimidoyl)amino]-6-(1-imidazolyl)-4-pyrimidinyl]-N-(phenylmethyl)pentanamide IUPAC Name: 5-[2-[amino(methanimidoyl)amino]-6-imidazol-1-ylpyrimidin-4-yl]-N-benzylpentanamide Traditional Name: 5-[2-[amino(formimidoyl)amino]-6-imidazol-1-yl-pyrimidin-4-yl]-N-benzyl-valeramide Formula: C20H24N8O MolecularWeight: 392.45756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCCC2=CC(=NC(=N2)N(C=N)N)N3C=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCCC2=CC(=NC(=N2)N(C=N)N)N3C=CN=C3

InChI

InChI=1S/C20H24N8O/c21-14-28(22)20-25-17(12-18(26-20)27-11-10-23-15-27)8-4-5-9-19(29)24-13-16-6-2-1-3-7-16/h1-3,6-7,10-12,14-15,21H,4-5,8-9,13,22H2,(H,24,29)