(2-azanylsulfanylpurin-9-yl)methyl 2,2-dimethylpropanoate; oxiran-2-ylmethanol

Systemtic Name: (2-azanylsulfanylpurin-9-yl)methyl 2,2-dimethylpropanoate; oxiran-2-ylmethanol Openeye Name: (2-aminosulfanylpurin-9-yl)methyl 2,2-dimethylpropanoate; oxiran-2-ylmethanol CAS Name: 2,2-dimethylpropanoic acid [2-(aminothio)-9-purinyl]methyl ester; 2-oxiranylmethanol IUPAC Name: (2-aminosulfanylpurin-9-yl)methyl 2,2-dimethylpropanoate; oxiran-2-ylmethanol Traditional Name: 2,2-dimethylpropionic acid [2-(aminothio)purin-9-yl]methyl ester; oxiran-2-ylmethanol Formula: C14H21N5O4S MolecularWeight: 355.41264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=CN=C(N=C21)SN.C1C(O1)CO

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=CN=C(N=C21)SN.C1C(O1)CO

InChI

InChI=1S/C11H15N5O2S.C3H6O2/c1-11(2,3)9(17)18-6-16-5-14-7-4-13-10(19-12)15-8(7)16;4-1-3-2-5-3/h4-5H,6,12H2,1-3H3;3-4H,1-2H2