ethyl 2-[4-[4-(4-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-[4-(4-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-[4-(4-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-[4-(4-methoxyphenyl)-1-pyrazolyl]-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-(4-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-[4-(4-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18N4O3S/c1-3-25-17(23)12-26-18-19-9-8-16(21-18)22-11-14(10-20-22)13-4-6-15(24-2)7-5-13/h4-11H,3,12H2,1-2H3