4-(2-methylpropanoylcarbamothioylamino)-N-(phenylmethyl)benzamide

Systemtic Name: 4-(2-methylpropanoylcarbamothioylamino)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-(2-methylpropanoylcarbamothioylamino)benzamide CAS Name: 4-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-(2-methylpropanoylcarbamothioylamino)benzamide Traditional Name: N-benzyl-4-(isobutyrylthiocarbamoylamino)benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2

InChI

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