ethyl 2-methyl-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: ethyl 2-methyl-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: ethyl 2-methyl-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate CAS Name: 2-methyl-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-2-methyl-propionic acid ethyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC1=NC(=O)C=C(N1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)(C)SC1=NC(=O)C=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3S/c1-4-21-14(20)16(2,3)22-15-17-12(10-13(19)18-15)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3,(H,17,18,19)