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

Systemtic Name: 4,6-bis(azanyl)-7-(phenylmethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Openeye Name: 4,6-diamino-7-(benzyloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide CAS Name: 4,6-diamino-7-(phenylmethoxymethyl)-5-pyrrolo[2,3-d]pyrimidinecarbothioamide IUPAC Name: 4,6-diamino-7-(phenylmethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Traditional Name: 4,6-diamino-7-(benzoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide Formula: C15H16N6OS MolecularWeight: 328.39214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCN2C(=C(C3=C2N=CN=C3N)C(=S)N)N

Isomeric SMILES

C1=CC=C(C=C1)COCN2C(=C(C3=C2N=CN=C3N)C(=S)N)N

InChI

InChI=1S/C15H16N6OS/c16-12-10-11(14(18)23)13(17)21(15(10)20-7-19-12)8-22-6-9-4-2-1-3-5-9/h1-5,7H,6,8,17H2,(H2,18,23)(H2,16,19,20)