N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[(4-isopentyloxybenzoyl)amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[(4-isoamoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C25H33N3O4S/c1-4-5-6-16-31-21-11-7-19(8-12-21)23(29)26-25(33)28-27-24(30)20-9-13-22(14-10-20)32-17-15-18(2)3/h7-14,18H,4-6,15-17H2,1-3H3,(H,27,30)(H2,26,28,29,33)