2-chloranyl-N-[3-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 2-chloro-N-[3-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide CAS Name: 2-chloro-N-[3-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-chloro-N-[3-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 2-chloro-N-[3-(isovalerylthiocarbamoylamino)phenyl]benzamide Formula: C19H20ClN3O2S MolecularWeight: 389.899

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C19H20ClN3O2S/c1-12(2)10-17(24)23-19(26)22-14-7-5-6-13(11-14)21-18(25)15-8-3-4-9-16(15)20/h3-9,11-12H,10H2,1-2H3,(H,21,25)(H2,22,23,24,26)