methyl 2-[3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylethanoate

Systemtic Name: methyl 2-[3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylethanoate Openeye Name: methyl 2-[3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]sulfanylacetate CAS Name: 2-[[3-(2-methoxyphenyl)-2,5-dimethyl-7-pyrazolo[1,5-a]pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanylacetate Traditional Name: 2-[[3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]thio]acetic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)SCC(=O)OC)C)C3=CC=CC=C3OC

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)SCC(=O)OC)C)C3=CC=CC=C3OC

InChI

InChI=1S/C18H19N3O3S/c1-11-9-15(25-10-16(22)24-4)21-18(19-11)17(12(2)20-21)13-7-5-6-8-14(13)23-3/h5-9H,10H2,1-4H3