1,3-dimethyl-7-prop-2-ynyl-6-sulfanylidene-purin-2-one

Systemtic Name: 1,3-dimethyl-7-prop-2-ynyl-6-sulfanylidene-purin-2-one Openeye Name: 1,3-dimethyl-7-prop-2-ynyl-6-thioxo-purin-2-one CAS Name: 1,3-dimethyl-7-prop-2-ynyl-6-sulfanylidene-2-purinone IUPAC Name: 1,3-dimethyl-7-prop-2-ynyl-6-sulfanylidenepurin-2-one Traditional Name: 1,3-dimethyl-7-propargyl-6-thioxo-purin-2-one Formula: C10H10N4OS MolecularWeight: 234.2776

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=S)N(C1=O)C)N(C=N2)CC#C

Isomeric SMILES

CN1C2=C(C(=S)N(C1=O)C)N(C=N2)CC#C

InChI

InChI=1S/C10H10N4OS/c1-4-5-14-6-11-8-7(14)9(16)13(3)10(15)12(8)2/h1,6H,5H2,2-3H3