2-[[6-oxidanylidene-9-[[(2R)-oxolan-2-yl]methyl]-3H-purin-8-yl]sulfanyl]-N-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[[6-oxidanylidene-9-[[(2R)-oxolan-2-yl]methyl]-3H-purin-8-yl]sulfanyl]-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: N-(4-isopropylphenyl)-2-[[6-oxo-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-3H-purin-8-yl]sulfanyl]acetamide CAS Name: 2-[[6-oxo-9-[[(2R)-2-oxolanyl]methyl]-3H-purin-8-yl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-[[6-oxo-9-[[(2R)-oxolan-2-yl]methyl]-3H-purin-8-yl]sulfanyl]-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[[6-keto-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-3H-purin-8-yl]thio]-N-p-cumenyl-acetamide Formula: C21H25N5O3S MolecularWeight: 427.5199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2CC4CCCO4)NC=NC3=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2C[C@H]4CCCO4)NC=NC3=O

InChI

InChI=1S/C21H25N5O3S/c1-13(2)14-5-7-15(8-6-14)24-17(27)11-30-21-25-18-19(22-12-23-20(18)28)26(21)10-16-4-3-9-29-16/h5-8,12-13,16H,3-4,9-11H2,1-2H3,(H,24,27)(H,22,23,28)/t16-/m1/s1