3-(2,2-dimethylpropanoylamino)-N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-(2,2-dimethylpropanoylamino)-N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-(2,2-dimethylpropanoylamino)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]benzamide CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]-N-methyl-N-[2-[2-(methylthio)anilino]-2-oxoethyl]benzamide IUPAC Name: 3-(2,2-dimethylpropanoylamino)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-3-(pivaloylamino)benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C22H27N3O3S/c1-22(2,3)21(28)23-16-10-8-9-15(13-16)20(27)25(4)14-19(26)24-17-11-6-7-12-18(17)29-5/h6-13H,14H2,1-5H3,(H,23,28)(H,24,26)