N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-ethoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-ethoxyphenyl)sulfanyl-ethanamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-ethoxyphenyl)sulfanyl-acetamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyrazolyl]-2-[(4-ethoxyphenyl)thio]acetamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-ethoxyphenyl)sulfanylacetamide Traditional Name: N-[2-(4-chlorobenzyl)pyrazol-3-yl]-2-(p-phenetylthio)acetamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SCC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)SCC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-2-26-17-7-9-18(10-8-17)27-14-20(25)23-19-11-12-22-24(19)13-15-3-5-16(21)6-4-15/h3-12H,2,13-14H2,1H3,(H,23,25)