8-(3-chloranyl-2-oxidanylidene-propyl)sulfanyl-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-(3-chloranyl-2-oxidanylidene-propyl)sulfanyl-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(3-chloro-2-oxo-propyl)sulfanyl-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(3-chloro-2-oxopropyl)thio]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(3-chloro-2-oxopropyl)sulfanyl-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(3-chloro-2-keto-propyl)thio]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C10H11ClN4O3S MolecularWeight: 302.73734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC(=O)CCl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC(=O)CCl

InChI

InChI=1S/C10H11ClN4O3S/c1-14-7-6(8(17)15(2)10(14)18)12-9(13-7)19-4-5(16)3-11/h3-4H2,1-2H3,(H,12,13)