2-[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanamide

Systemtic Name: 2-[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanamide Openeye Name: 2-[5-(2-methyl-2,3-dihydrobenzofuran-5-yl)isoxazol-3-yl]-N-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetamide CAS Name: 2-[5-(2-methyl-2,3-dihydrobenzofuran-5-yl)-3-isoxazolyl]-N-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetamide IUPAC Name: 2-[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]-N-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetamide Traditional Name: N-(4-keto-2-thioxo-1H-pyrimidin-6-yl)-2-[5-(2-methylcoumaran-5-yl)isoxazol-3-yl]acetamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)CC(=O)NC4=CC(=O)NC(=S)N4

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)CC(=O)NC4=CC(=O)NC(=S)N4

InChI

InChI=1S/C18H16N4O4S/c1-9-4-11-5-10(2-3-13(11)25-9)14-6-12(22-26-14)7-16(23)19-15-8-17(24)21-18(27)20-15/h2-3,5-6,8-9H,4,7H2,1H3,(H3,19,20,21,23,24,27)