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

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-(3,4-dimethylphenyl)sulfanyl-ethanamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-(3,4-dimethylphenyl)sulfanyl-acetamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-[(3,4-dimethylphenyl)thio]acetamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-(3,4-dimethylphenyl)sulfanylacetamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-[(3,4-dimethylphenyl)thio]acetamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C23H27N3OS/c1-16-10-11-21(12-17(16)2)28-15-23(27)24-13-22-18(3)25-26(19(22)4)14-20-8-6-5-7-9-20/h5-12H,13-15H2,1-4H3,(H,24,27)