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

Systemtic Name: methyl 2-[2-[[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[[2-(4-ethylphenyl)thiazol-4-yl]methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-(4-ethylphenyl)-4-thiazolyl]methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-(4-ethylphenyl)thiazol-4-yl]methylthio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC(=O)C=C(N3)CC(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC(=O)C=C(N3)CC(=O)OC

InChI

InChI=1S/C19H19N3O3S2/c1-3-12-4-6-13(7-5-12)18-20-15(10-26-18)11-27-19-21-14(8-16(23)22-19)9-17(24)25-2/h4-8,10H,3,9,11H2,1-2H3,(H,21,22,23)