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

Systemtic Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methyl-butanamide Openeye Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methyl-butanamide CAS Name: N-[4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)phenyl]-3-methylbutanamide Traditional Name: 3-methyl-N-[4-(pivaloylthiocarbamoylamino)phenyl]butyramide Formula: C17H25N3O2S MolecularWeight: 335.4643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C17H25N3O2S/c1-11(2)10-14(21)18-12-6-8-13(9-7-12)19-16(23)20-15(22)17(3,4)5/h6-9,11H,10H2,1-5H3,(H,18,21)(H2,19,20,22,23)