N-butyl-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-butyl-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide Openeye Name: N-butyl-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide CAS Name: N-butyl-3-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide Traditional Name: N-butyl-3-(pivaloylthiocarbamoylamino)benzamide Formula: C17H25N3O2S MolecularWeight: 335.4643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C17H25N3O2S/c1-5-6-10-18-14(21)12-8-7-9-13(11-12)19-16(23)20-15(22)17(2,3)4/h7-9,11H,5-6,10H2,1-4H3,(H,18,21)(H2,19,20,22,23)