N-(2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-(2,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-(2,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: 4-iodo-N-(4-keto-2,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)-1-methyl-pyrazole-3-carboxamide Formula: C13H12IN5O2S MolecularWeight: 429.23615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=NN(C=C3I)C)C

Isomeric SMILES

CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=NN(C=C3I)C)C

InChI

InChI=1S/C13H12IN5O2S/c1-6-4-8-12(22-6)15-7(2)19(13(8)21)17-11(20)10-9(14)5-18(3)16-10/h4-5H,1-3H3,(H,17,20)