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

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(4-methoxyphenyl)thio]acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-14-20(15(2)23(22-14)16-7-5-4-6-8-16)21-19(24)13-26-18-11-9-17(25-3)10-12-18/h4-12H,13H2,1-3H3,(H,21,24)