N-tert-butyl-3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: N-tert-butyl-3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: N-tert-butyl-3-[[2-(o-tolyl)acetyl]carbamothioylamino]benzamide CAS Name: N-tert-butyl-3-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-[[2-(2-methylphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: N-tert-butyl-3-[[2-(o-tolyl)acetyl]thiocarbamoylamino]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H25N3O2S/c1-14-8-5-6-9-15(14)13-18(25)23-20(27)22-17-11-7-10-16(12-17)19(26)24-21(2,3)4/h5-12H,13H2,1-4H3,(H,24,26)(H2,22,23,25,27)