N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide Openeye Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbenzamide IUPAC Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methylbenzamide Traditional Name: 3-methyl-N-[4-(pivaloylthiocarbamoylamino)phenyl]benzamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C20H23N3O2S/c1-13-6-5-7-14(12-13)17(24)21-15-8-10-16(11-9-15)22-19(26)23-18(25)20(2,3)4/h5-12H,1-4H3,(H,21,24)(H2,22,23,25,26)