N-[[3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(3-propionamidophenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C17H23N3O2S/c1-2-15(21)18-13-9-6-10-14(11-13)19-17(23)20-16(22)12-7-4-3-5-8-12/h6,9-12H,2-5,7-8H2,1H3,(H,18,21)(H2,19,20,22,23)