2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N,N-dicyclohexyl-ethanamide

Systemtic Name: 2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N,N-dicyclohexyl-ethanamide Openeye Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)-N,N-dicyclohexyl-acetamide CAS Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)-N,N-dicyclohexylacetamide IUPAC Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)-N,N-dicyclohexylacetamide Traditional Name: 2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)-N,N-dicyclohexyl-acetamide Formula: C21H30ClN5O3 MolecularWeight: 435.9476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C21H30ClN5O3/c1-24-18-17(19(29)25(2)21(24)30)26(20(22)23-18)13-16(28)27(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h14-15H,3-13H2,1-2H3