methyl 2-[4-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[(2-phenylthiazol-4-yl)methylsulfanyl]-1H-pyrimidin-6-yl]acetate CAS Name: 2-[4-oxo-2-[(2-phenyl-4-thiazolyl)methylthio]-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[(2-phenylthiazol-4-yl)methylthio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O3S2/c1-23-15(22)8-12-7-14(21)20-17(19-12)25-10-13-9-24-16(18-13)11-5-3-2-4-6-11/h2-7,9H,8,10H2,1H3,(H,19,20,21)