N-[(2,2-diphenylethanoylamino)carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[(2,2-diphenylethanoylamino)carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[(2,2-diphenylacetyl)amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[(1-oxo-2,2-diphenylethyl)hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[(2,2-diphenylacetyl)amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[(2,2-diphenylacetyl)amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S/c26-20(18-14-8-3-9-15-18)23-22(28)25-24-21(27)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,18-19H,3,8-9,14-15H2,(H,24,27)(H2,23,25,26,28)