1-(2-azanyl-6-sulfanylidene-3,7-dihydropurin-8-yl)-2-methyl-propan-1-one

Systemtic Name: 1-(2-azanyl-6-sulfanylidene-3,7-dihydropurin-8-yl)-2-methyl-propan-1-one Openeye Name: 1-(2-amino-6-thioxo-3,7-dihydropurin-8-yl)-2-methyl-propan-1-one CAS Name: 1-(2-amino-6-sulfanylidene-3,7-dihydropurin-8-yl)-2-methyl-1-propanone IUPAC Name: 1-(2-amino-6-sulfanylidene-3,7-dihydropurin-8-yl)-2-methylpropan-1-one Traditional Name: 1-(2-amino-6-thioxo-3,7-dihydropurin-8-yl)-2-methyl-propan-1-one Formula: C9H11N5OS MolecularWeight: 237.28154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=NC2=C(N1)C(=S)N=C(N2)N

Isomeric SMILES

CC(C)C(=O)C1=NC2=C(N1)C(=S)N=C(N2)N

InChI

InChI=1S/C9H11N5OS/c1-3(2)5(15)7-11-4-6(12-7)13-9(10)14-8(4)16/h3H,1-2H3,(H4,10,11,12,13,14,16)