4-[(9-cyclopentyl-7-methyl-8-oxidanylidene-purin-2-yl)amino]-N-(3-imidazol-1-ylpropyl)-3-methoxy-benzamide

Systemtic Name: 4-[(9-cyclopentyl-7-methyl-8-oxidanylidene-purin-2-yl)amino]-N-(3-imidazol-1-ylpropyl)-3-methoxy-benzamide Openeye Name: 4-[(9-cyclopentyl-7-methyl-8-oxo-purin-2-yl)amino]-N-(3-imidazol-1-ylpropyl)-3-methoxy-benzamide CAS Name: 4-[(9-cyclopentyl-7-methyl-8-oxo-2-purinyl)amino]-N-[3-(1-imidazolyl)propyl]-3-methoxybenzamide IUPAC Name: 4-[(9-cyclopentyl-7-methyl-8-oxopurin-2-yl)amino]-N-(3-imidazol-1-ylpropyl)-3-methoxybenzamide Traditional Name: 4-[(9-cyclopentyl-8-keto-7-methyl-purin-2-yl)amino]-N-(3-imidazol-1-ylpropyl)-3-methoxy-benzamide Formula: C25H30N8O3 MolecularWeight: 490.5575

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=C(C=C(C=C4)C(=O)NCCCN5C=CN=C5)OC

Isomeric SMILES

CN1C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=C(C=C(C=C4)C(=O)NCCCN5C=CN=C5)OC

InChI

InChI=1S/C25H30N8O3/c1-31-20-15-28-24(30-22(20)33(25(31)35)18-6-3-4-7-18)29-19-9-8-17(14-21(19)36-2)23(34)27-10-5-12-32-13-11-26-16-32/h8-9,11,13-16,18H,3-7,10,12H2,1-2H3,(H,27,34)(H,28,29,30)