N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(4-methoxyphenyl)thio]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CSC3=CC=C(C=C3)OC

InChI

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