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

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-benzamide CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-[(2-indolin-1-yl-2-keto-ethyl)thio]benzamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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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)N4CCC5=CC=CC=C54

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3SCC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C29H28N4O2S/c1-20-25(21(2)33(31-20)23-11-4-3-5-12-23)18-30-29(35)24-13-7-9-15-27(24)36-19-28(34)32-17-16-22-10-6-8-14-26(22)32/h3-15H,16-19H2,1-2H3,(H,30,35)