2-[2,2-dimethylpropanoylcarbamothioyl(methyl)amino]-N-phenethyl-benzamide

Systemtic Name: 2-[2,2-dimethylpropanoylcarbamothioyl(methyl)amino]-N-phenethyl-benzamide Openeye Name: 2-[2,2-dimethylpropanoylcarbamothioyl(methyl)amino]-N-phenethyl-benzamide CAS Name: 2-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]-methylamino]-N-phenethylbenzamide IUPAC Name: 2-[2,2-dimethylpropanoylcarbamothioyl(methyl)amino]-N-phenethylbenzamide Traditional Name: 2-[methyl(pivaloylthiocarbamoyl)amino]-N-phenethyl-benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O2S/c1-22(2,3)20(27)24-21(28)25(4)18-13-9-8-12-17(18)19(26)23-15-14-16-10-6-5-7-11-16/h5-13H,14-15H2,1-4H3,(H,23,26)(H,24,27,28)