2-azanyl-8-(1,2-thiazol-4-ylmethyl)-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-(1,2-thiazol-4-ylmethyl)-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-(isothiazol-4-ylmethyl)-3,7-dihydropurin-6-one CAS Name: 2-amino-8-(4-isothiazolylmethyl)-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-(1,2-thiazol-4-ylmethyl)-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-(isothiazol-4-ylmethyl)-3,7-dihydropurin-6-one Formula: C9H8N6OS MolecularWeight: 248.26442

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NS1)CC2=NC3=C(N2)C(=O)N=C(N3)N

Isomeric SMILES

C1=C(C=NS1)CC2=NC3=C(N2)C(=O)N=C(N3)N

InChI

InChI=1S/C9H8N6OS/c10-9-14-7-6(8(16)15-9)12-5(13-7)1-4-2-11-17-3-4/h2-3H,1H2,(H4,10,12,13,14,15,16)