ethyl 2-methylsulfanyl-4-[[(Z)-(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-[[(Z)-(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-[[(Z)-(5-oxo-2-phenyl-oxazol-4-ylidene)methyl]amino]pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-[[(Z)-(5-oxo-2-phenyl-4-oxazolylidene)methyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-[[(Z)-(5-oxo-2-phenyl-1,3-oxazol-4-ylidene)methyl]amino]pyrimidine-5-carboxylate Traditional Name: 4-[[(Z)-(5-keto-2-phenyl-2-oxazolin-4-ylidene)methyl]amino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC=C2C(=O)OC(=N2)C3=CC=CC=C3)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N/C=C\2/C(=O)OC(=N2)C3=CC=CC=C3)SC

InChI

InChI=1S/C18H16N4O4S/c1-3-25-16(23)12-9-20-18(27-2)22-14(12)19-10-13-17(24)26-15(21-13)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,19,20,22)/b13-10-