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

Systemtic Name: N-[[[4-(cyclohexylcarbonylamino)phenyl]carbonylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]thiocarbamoyl]benzamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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)NC(=O)C3CCCCC3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C27H34N4O4S/c1-2-3-7-18-35-23-16-12-20(13-17-23)25(33)29-27(36)31-30-26(34)21-10-14-22(15-11-21)28-24(32)19-8-5-4-6-9-19/h10-17,19H,2-9,18H2,1H3,(H,28,32)(H,30,34)(H2,29,31,33,36)