4-tert-butyl-N-[4-(2-phenoxyethanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-(2-phenoxyethanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[(2-phenoxyacetyl)carbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[(2-phenoxyacetyl)carbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[(2-phenoxyacetyl)thiocarbamoylamino]phenyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-26(2,3)19-11-9-18(10-12-19)24(31)27-20-13-15-21(16-14-20)28-25(33)29-23(30)17-32-22-7-5-4-6-8-22/h4-16H,17H2,1-3H3,(H,27,31)(H2,28,29,30,33)