N-(5-tert-butyl-2-methoxy-phenyl)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]benzamide Formula: C26H27FN2O3S MolecularWeight: 466.567583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C26H27FN2O3S/c1-26(2,3)17-9-14-22(32-4)21(15-17)29-25(31)20-7-5-6-8-23(20)33-16-24(30)28-19-12-10-18(27)11-13-19/h5-15H,16H2,1-4H3,(H,28,30)(H,29,31)