N-[6-iodanyl-4-oxidanylidene-7-(thiophen-3-ylmethyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[6-iodanyl-4-oxidanylidene-7-(thiophen-3-ylmethyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethyl-propanamide Openeye Name: N-[6-iodo-4-oxo-7-(3-thienylmethyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethyl-propanamide CAS Name: N-[6-iodo-4-oxo-7-(3-thiophenylmethyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethylpropanamide IUPAC Name: N-[6-iodo-4-oxo-7-(thiophen-3-ylmethyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethylpropanamide Traditional Name: N-[6-iodo-4-keto-7-(3-thenyl)-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl]-2,2-dimethyl-propionamide Formula: C16H17IN4O2S MolecularWeight: 456.30125

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NC(=O)C2=C(N1)C(=C(N2)I)CC3=CSC=C3

Isomeric SMILES

CC(C)(C)C(=O)NC1=NC(=O)C2=C(N1)C(=C(N2)I)CC3=CSC=C3

InChI

InChI=1S/C16H17IN4O2S/c1-16(2,3)14(23)21-15-19-10-9(6-8-4-5-24-7-8)12(17)18-11(10)13(22)20-15/h4-5,7,18H,6H2,1-3H3,(H2,19,20,21,22,23)