2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-3-phenyl-5-propan-2-yl-pyrimidin-4-olate

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-3-phenyl-5-propan-2-yl-pyrimidin-4-olate Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-5-isopropyl-6-oxo-3-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-6-oxo-3-phenyl-5-propan-2-yl-4-pyrimidinolate IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-6-oxo-3-phenyl-5-propan-2-ylpyrimidin-4-olate Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-5-isopropyl-6-keto-3-phenyl-pyrimidin-4-olate Formula: C20H20N3O4S- MolecularWeight: 398.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=NC1=O)SCC(=O)NCC2=CC=CO2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=NC1=O)SCC(=O)NCC2=CC=CO2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H21N3O4S/c1-13(2)17-18(25)22-20(23(19(17)26)14-7-4-3-5-8-14)28-12-16(24)21-11-15-9-6-10-27-15/h3-10,13,26H,11-12H2,1-2H3,(H,21,24)/p-1