N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-phenethyloxy-benzamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-27(2,3)21-15-13-20(14-16-21)24(31)29-30-26(34)28-25(32)22-11-7-8-12-23(22)33-18-17-19-9-5-4-6-10-19/h4-16H,17-18H2,1-3H3,(H,29,31)(H2,28,30,32,34)