N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)COC3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)COC3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C22H23N3O2S2/c1-15-21(16(2)25(24-15)18-6-4-3-5-7-18)23-20(26)14-27-19-10-8-17(9-11-19)22-28-12-13-29-22/h3-11,22H,12-14H2,1-2H3,(H,23,26)