2-[[5-(methoxymethyl)furan-2-yl]methylideneamino]-8-sulfanylidene-7,9-dihydro-3H-purin-6-one

Systemtic Name: 2-[[5-(methoxymethyl)furan-2-yl]methylideneamino]-8-sulfanylidene-7,9-dihydro-3H-purin-6-one Openeye Name: 2-[[5-(methoxymethyl)-2-furyl]methyleneamino]-8-thioxo-7,9-dihydro-3H-purin-6-one CAS Name: 2-[[5-(methoxymethyl)-2-furanyl]methylideneamino]-8-sulfanylidene-7,9-dihydro-3H-purin-6-one IUPAC Name: 2-[[5-(methoxymethyl)furan-2-yl]methylideneamino]-8-sulfanylidene-7,9-dihydro-3H-purin-6-one Traditional Name: 2-[[5-(methoxymethyl)-2-furyl]methyleneamino]-8-thioxo-7,9-dihydro-3H-purin-6-one Formula: C12H11N5O3S MolecularWeight: 305.31244

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(O1)C=NC2=NC(=O)C3=C(N2)NC(=S)N3

Isomeric SMILES

COCC1=CC=C(O1)C=NC2=NC(=O)C3=C(N2)NC(=S)N3

InChI

InChI=1S/C12H11N5O3S/c1-19-5-7-3-2-6(20-7)4-13-11-15-9-8(10(18)17-11)14-12(21)16-9/h2-4H,5H2,1H3,(H3,14,15,16,17,18,21)