N-[[[4-(cyclohexylcarbonylamino)phenyl]carbonylamino]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[[4-(cyclohexylcarbonylamino)phenyl]carbonylamino]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]thiocarbamoyl]-2-hexoxy-benzamide Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C28H36N4O4S/c1-2-3-4-10-19-36-24-14-9-8-13-23(24)27(35)30-28(37)32-31-26(34)21-15-17-22(18-16-21)29-25(33)20-11-6-5-7-12-20/h8-9,13-18,20H,2-7,10-12,19H2,1H3,(H,29,33)(H,31,34)(H2,30,32,35,37)