4,6-bis(azanyl)-7-(2-hydroxyethyloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

Systemtic Name: 4,6-bis(azanyl)-7-(2-hydroxyethyloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Openeye Name: 4,6-diamino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide CAS Name: 4,6-diamino-7-(2-hydroxyethoxymethyl)-5-pyrrolo[2,3-d]pyrimidinecarbothioamide IUPAC Name: 4,6-diamino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Traditional Name: 4,6-diamino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Formula: C10H14N6O2S MolecularWeight: 282.32216

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=C(N2COCCO)N)C(=S)N)C(=N1)N

Isomeric SMILES

C1=NC2=C(C(=C(N2COCCO)N)C(=S)N)C(=N1)N

InChI

InChI=1S/C10H14N6O2S/c11-7-5-6(9(13)19)8(12)16(4-18-2-1-17)10(5)15-3-14-7/h3,17H,1-2,4,12H2,(H2,13,19)(H2,11,14,15)