N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[2-methyl-3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(2-methyl-3-propionamido-phenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O2S/c1-3-16(22)19-14-10-7-11-15(12(14)2)20-18(24)21-17(23)13-8-5-4-6-9-13/h7,10-11,13H,3-6,8-9H2,1-2H3,(H,19,22)(H2,20,21,23,24)