N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(S)-ethylsulfinyl]-N-methyl-benzamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(S)-ethylsulfinyl]-N-methyl-benzamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(S)-ethylsulfinyl]-N-methyl-benzamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-[(S)-ethylsulfinyl]-N-methylbenzamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-[(S)-ethylsulfinyl]-N-methylbenzamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(S)-ethylsulfinyl]-N-methyl-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=CC=C1C(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC[S@](=O)C1=CC=CC=C1C(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O2S/c1-5-28(27)21-14-10-9-13-19(21)22(26)24(4)15-20-16(2)23-25(17(20)3)18-11-7-6-8-12-18/h6-14H,5,15H2,1-4H3/t28-/m0/s1