2-[7-butyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[7-butyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-(7-butyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanyl-N-(2-morpholinophenyl)acetamide CAS Name: 2-[(7-butyl-1,3-dimethyl-2,6-dioxo-8-purinyl)thio]-N-[2-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-(7-butyl-1,3-dimethyl-2,6-dioxopurin-8-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[(7-butyl-2,6-diketo-1,3-dimethyl-purin-8-yl)thio]-N-(2-morpholinophenyl)acetamide Formula: C23H30N6O4S MolecularWeight: 486.5871

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1SCC(=O)NC3=CC=CC=C3N4CCOCC4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCN1C2=C(N=C1SCC(=O)NC3=CC=CC=C3N4CCOCC4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C23H30N6O4S/c1-4-5-10-29-19-20(26(2)23(32)27(3)21(19)31)25-22(29)34-15-18(30)24-16-8-6-7-9-17(16)28-11-13-33-14-12-28/h6-9H,4-5,10-15H2,1-3H3,(H,24,30)