3-methyl-7-prop-2-enyl-8-sulfanylidene-9H-purine-2,6-dione

Systemtic Name: 3-methyl-7-prop-2-enyl-8-sulfanylidene-9H-purine-2,6-dione Openeye Name: 7-allyl-3-methyl-8-thioxo-9H-purine-2,6-dione CAS Name: 3-methyl-7-prop-2-enyl-8-sulfanylidene-9H-purine-2,6-dione IUPAC Name: 3-methyl-7-prop-2-enyl-8-sulfanylidene-9H-purine-2,6-dione Traditional Name: 7-allyl-3-methyl-8-thioxo-9H-purine-2,6-quinone Formula: C9H10N4O2S MolecularWeight: 238.2663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=S)N2)CC=C

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=S)N2)CC=C

InChI

InChI=1S/C9H10N4O2S/c1-3-4-13-5-6(10-9(13)16)12(2)8(15)11-7(5)14/h3H,1,4H2,2H3,(H,10,16)(H,11,14,15)