N-(3-chloranyl-2-methyl-phenyl)-2-(cyclohexylcarbamothioylamino)ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(cyclohexylcarbamothioylamino)ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(cyclohexylcarbamothioylamino)acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(cyclohexylcarbamothioylamino)acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-(cyclohexylthiocarbamoylamino)acetamide Formula: C16H22ClN3OS MolecularWeight: 339.88338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=S)NC2CCCCC2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=S)NC2CCCCC2

InChI

InChI=1S/C16H22ClN3OS/c1-11-13(17)8-5-9-14(11)20-15(21)10-18-16(22)19-12-6-3-2-4-7-12/h5,8-9,12H,2-4,6-7,10H2,1H3,(H,20,21)(H2,18,19,22)