6-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethyl]sulfanyl-N-cyclohexyl-N-methyl-pyridine-3-sulfonamide

Systemtic Name: 6-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethyl]sulfanyl-N-cyclohexyl-N-methyl-pyridine-3-sulfonamide Openeye Name: 6-[2-(6-amino-1-cyclopropyl-2,4-dioxo-pyrimidin-5-yl)-2-oxo-ethyl]sulfanyl-N-cyclohexyl-N-methyl-pyridine-3-sulfonamide CAS Name: 6-[[2-(6-amino-1-cyclopropyl-2,4-dioxo-5-pyrimidinyl)-2-oxoethyl]thio]-N-cyclohexyl-N-methyl-3-pyridinesulfonamide IUPAC Name: 6-[2-(6-amino-1-cyclopropyl-2,4-dioxopyrimidin-5-yl)-2-oxoethyl]sulfanyl-N-cyclohexyl-N-methylpyridine-3-sulfonamide Traditional Name: 6-[[2-(6-amino-1-cyclopropyl-2,4-diketo-pyrimidin-5-yl)-2-keto-ethyl]thio]-N-cyclohexyl-N-methyl-pyridine-3-sulfonamide Formula: C21H27N5O5S2 MolecularWeight: 493.59958

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

InChI

InChI=1S/C21H27N5O5S2/c1-25(13-5-3-2-4-6-13)33(30,31)15-9-10-17(23-11-15)32-12-16(27)18-19(22)26(14-7-8-14)21(29)24-20(18)28/h9-11,13-14H,2-8,12,22H2,1H3,(H,24,28,29)