N,N-dimethyl-2-(3-methylbutanoylcarbamothioylamino)benzamide

Systemtic Name: N,N-dimethyl-2-(3-methylbutanoylcarbamothioylamino)benzamide Openeye Name: N,N-dimethyl-2-(3-methylbutanoylcarbamothioylamino)benzamide CAS Name: N,N-dimethyl-2-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N,N-dimethyl-2-(3-methylbutanoylcarbamothioylamino)benzamide Traditional Name: 2-(isovalerylthiocarbamoylamino)-N,N-dimethyl-benzamide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)C

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)C

InChI

InChI=1S/C15H21N3O2S/c1-10(2)9-13(19)17-15(21)16-12-8-6-5-7-11(12)14(20)18(3)4/h5-8,10H,9H2,1-4H3,(H2,16,17,19,21)