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

Systemtic Name: N,N-dicyclohexyl-2-[1,3-dimethyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]sulfanyl-ethanamide Openeye Name: N,N-dicyclohexyl-2-(1,3-dimethyl-2,6-dioxo-7-propyl-purin-8-yl)sulfanyl-acetamide CAS Name: N,N-dicyclohexyl-2-[(1,3-dimethyl-2,6-dioxo-7-propyl-8-purinyl)thio]acetamide IUPAC Name: N,N-dicyclohexyl-2-(1,3-dimethyl-2,6-dioxo-7-propylpurin-8-yl)sulfanylacetamide Traditional Name: N,N-dicyclohexyl-2-[(2,6-diketo-1,3-dimethyl-7-propyl-purin-8-yl)thio]acetamide Formula: C24H37N5O3S MolecularWeight: 475.64728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1SCC(=O)N(C3CCCCC3)C4CCCCC4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1SCC(=O)N(C3CCCCC3)C4CCCCC4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C24H37N5O3S/c1-4-15-28-20-21(26(2)24(32)27(3)22(20)31)25-23(28)33-16-19(30)29(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h17-18H,4-16H2,1-3H3