2-(4-ethoxyphenyl)sulfanyl-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]ethanamide

Systemtic Name: 2-(4-ethoxyphenyl)sulfanyl-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]ethanamide Openeye Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-2-(4-ethoxyphenyl)sulfanyl-acetamide CAS Name: 2-[(4-ethoxyphenyl)thio]-N-[5-methyl-2-(phenylmethyl)-3-pyrazolyl]acetamide IUPAC Name: N-(2-benzyl-5-methylpyrazol-3-yl)-2-(4-ethoxyphenyl)sulfanylacetamide Traditional Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-2-(p-phenetylthio)acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2S/c1-3-26-18-9-11-19(12-10-18)27-15-21(25)22-20-13-16(2)23-24(20)14-17-7-5-4-6-8-17/h4-13H,3,14-15H2,1-2H3,(H,22,25)