4-[(6-chloranylpurin-7-yl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxy-benzamide

Systemtic Name: 4-[(6-chloranylpurin-7-yl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxy-benzamide Openeye Name: 4-[(6-chloropurin-7-yl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxy-benzamide CAS Name: 4-[(6-chloro-7-purinyl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxybenzamide IUPAC Name: 4-[(6-chloropurin-7-yl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxybenzamide Traditional Name: 4-[(6-chloropurin-7-yl)methyl]-N-cyclohexyl-N-cyclopentyl-3-methoxy-benzamide Formula: C25H30ClN5O2 MolecularWeight: 467.991

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N(C2CCCCC2)C3CCCC3)CN4C=NC5=C4C(=NC=N5)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N(C2CCCCC2)C3CCCC3)CN4C=NC5=C4C(=NC=N5)Cl

InChI

InChI=1S/C25H30ClN5O2/c1-33-21-13-17(25(32)31(20-9-5-6-10-20)19-7-3-2-4-8-19)11-12-18(21)14-30-16-29-24-22(30)23(26)27-15-28-24/h11-13,15-16,19-20H,2-10,14H2,1H3