5-[[[5-cyano-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]methyl]thiophene-2-sulfonamide

Systemtic Name: 5-[[[5-cyano-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]amino]methyl]thiophene-2-sulfonamide Openeye Name: 5-[[(5-cyano-1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)amino]methyl]thiophene-2-sulfonamide CAS Name: 5-[[(5-cyano-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)amino]methyl]-2-thiophenesulfonamide IUPAC Name: 5-[[(5-cyano-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)amino]methyl]thiophene-2-sulfonamide Traditional Name: 5-[[(5-cyano-2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)amino]methyl]thiophene-2-sulfonamide Formula: C12H13N5O4S2 MolecularWeight: 355.39272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)NCC2=CC=C(S2)S(=O)(=O)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)NCC2=CC=C(S2)S(=O)(=O)N

InChI

InChI=1S/C12H13N5O4S2/c1-16-10(8(5-13)11(18)17(2)12(16)19)15-6-7-3-4-9(22-7)23(14,20)21/h3-4,15H,6H2,1-2H3,(H2,14,20,21)