N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-3-phenyl-propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O2S/c1-21(2,3)17-12-10-16(11-13-17)19(26)23-24-20(27)22-18(25)14-9-15-7-5-4-6-8-15/h4-8,10-13H,9,14H2,1-3H3,(H,23,26)(H2,22,24,25,27)