1,3,7-trimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 1,3,7-trimethyl-8-[(2E)-2-(2-thienylmethylene)hydrazino]purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]purine-2,6-dione Traditional Name: 1,3,7-trimethyl-8-[(N'E)-N'-(2-thenylidene)hydrazino]xanthine Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NN=CC3=CC=CS3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1N/N=C/C3=CC=CS3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C13H14N6O2S/c1-17-9-10(18(2)13(21)19(3)11(9)20)15-12(17)16-14-7-8-5-4-6-22-8/h4-7H,1-3H3,(H,15,16)/b14-7+