N-[2-[(2,4-dimethoxyphenyl)methyl]pyrazol-3-yl]-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-[(2,4-dimethoxyphenyl)methyl]pyrazol-3-yl]-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[2-[(2,4-dimethoxyphenyl)methyl]pyrazol-3-yl]-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-[2-[(2,4-dimethoxyphenyl)methyl]-3-pyrazolyl]-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-[2-[(2,4-dimethoxyphenyl)methyl]pyrazol-3-yl]-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-[2-(2,4-dimethoxybenzyl)pyrazol-3-yl]-2-[(4-fluorophenyl)thio]acetamide Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2C(=CC=N2)NC(=O)CSC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2C(=CC=N2)NC(=O)CSC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H20FN3O3S/c1-26-16-6-3-14(18(11-16)27-2)12-24-19(9-10-22-24)23-20(25)13-28-17-7-4-15(21)5-8-17/h3-11H,12-13H2,1-2H3,(H,23,25)