N-(3,4-dimethoxyphenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1-methyl-6-oxidanylidene-pyrimidine-5-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1-methyl-6-oxidanylidene-pyrimidine-5-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-1-methyl-6-oxo-pyrimidine-5-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1-methyl-6-oxo-5-pyrimidinecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-1-methyl-6-oxopyrimidine-5-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-6-keto-1-methyl-pyrimidine-5-carboxamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN=C1SCC(=O)NCC2=CC=CO2)C(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C(=O)C(=CN=C1SCC(=O)NCC2=CC=CO2)C(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N4O6S/c1-25-20(28)15(19(27)24-13-6-7-16(29-2)17(9-13)30-3)11-23-21(25)32-12-18(26)22-10-14-5-4-8-31-14/h4-9,11H,10,12H2,1-3H3,(H,22,26)(H,24,27)