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

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1-methyl-N-(4-methylphenyl)-6-oxidanylidene-pyrimidine-5-carboxamide Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-1-methyl-6-oxo-N-(p-tolyl)pyrimidine-5-carboxamide CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1-methyl-N-(4-methylphenyl)-6-oxo-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-1-methyl-N-(4-methylphenyl)-6-oxopyrimidine-5-carboxamide Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-6-keto-1-methyl-N-(p-tolyl)pyrimidine-5-carboxamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CN=C(N(C2=O)C)SCC(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CN=C(N(C2=O)C)SCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H20N4O4S/c1-13-5-7-14(8-6-13)23-18(26)16-11-22-20(24(2)19(16)27)29-12-17(25)21-10-15-4-3-9-28-15/h3-9,11H,10,12H2,1-2H3,(H,21,25)(H,23,26)