N-[4-[(3-phenylpropanoylcarbamothioylamino)carbamoyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[(3-phenylpropanoylcarbamothioylamino)carbamoyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[(3-phenylpropanoylcarbamothioylamino)carbamoyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[oxo-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]hydrazo]methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[(3-phenylpropanoylcarbamothioylamino)carbamoyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[(hydrocinnamoylthiocarbamoylamino)carbamoyl]phenyl]cyclohexanecarboxamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H28N4O3S/c29-21(16-11-17-7-3-1-4-8-17)26-24(32)28-27-23(31)19-12-14-20(15-13-19)25-22(30)18-9-5-2-6-10-18/h1,3-4,7-8,12-15,18H,2,5-6,9-11,16H2,(H,25,30)(H,27,31)(H2,26,28,29,32)