2-chloranyl-N-cyclohexyl-5-(3-methylbutanoylcarbamothioylamino)benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-(3-methylbutanoylcarbamothioylamino)benzamide Openeye Name: 2-chloro-N-cyclohexyl-5-(3-methylbutanoylcarbamothioylamino)benzamide CAS Name: 2-chloro-N-cyclohexyl-5-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-chloro-N-cyclohexyl-5-(3-methylbutanoylcarbamothioylamino)benzamide Traditional Name: 2-chloro-N-cyclohexyl-5-(isovalerylthiocarbamoylamino)benzamide Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC(=C(C=C1)Cl)C(=O)NC2CCCCC2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC(=C(C=C1)Cl)C(=O)NC2CCCCC2

InChI

InChI=1S/C19H26ClN3O2S/c1-12(2)10-17(24)23-19(26)22-14-8-9-16(20)15(11-14)18(25)21-13-6-4-3-5-7-13/h8-9,11-13H,3-7,10H2,1-2H3,(H,21,25)(H2,22,23,24,26)