2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3SCC(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3SCC(=O)N(C)C

InChI

InChI=1S/C23H26N4O2S/c1-16-20(17(2)27(25-16)18-10-6-5-7-11-18)14-24-23(29)19-12-8-9-13-21(19)30-15-22(28)26(3)4/h5-13H,14-15H2,1-4H3,(H,24,29)