N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-(2-thienylmethylsulfanyl)benzamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-(thiophen-2-ylmethylthio)benzamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-(2-thenylthio)benzamide Formula: C25H25N3OS2 MolecularWeight: 447.6155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3SCC4=CC=CS4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3SCC4=CC=CS4

InChI

InChI=1S/C25H25N3OS2/c1-18-23(19(2)28(27-18)16-20-9-4-3-5-10-20)15-26-25(29)22-12-6-7-13-24(22)31-17-21-11-8-14-30-21/h3-14H,15-17H2,1-2H3,(H,26,29)