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

Systemtic Name: 4-tert-butyl-N-[4-[(2-phenoxyethanoylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[[(2-phenoxyacetyl)carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[oxo-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[[(2-phenoxyacetyl)carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[[(2-phenoxyacetyl)thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C27H28N4O4S MolecularWeight: 504.60062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O4S/c1-27(2,3)20-13-9-18(10-14-20)24(33)28-21-15-11-19(12-16-21)25(34)30-31-26(36)29-23(32)17-35-22-7-5-4-6-8-22/h4-16H,17H2,1-3H3,(H,28,33)(H,30,34)(H2,29,31,32,36)