N-[4-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: N-[4-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide Openeye Name: N-[4-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide CAS Name: N-[4-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[4-(3-methylbutanoylcarbamothioylamino)phenyl]benzamide Traditional Name: N-[4-(isovalerylthiocarbamoylamino)phenyl]benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O2S/c1-13(2)12-17(23)22-19(25)21-16-10-8-15(9-11-16)20-18(24)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H2,21,22,23,25)