N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: 2,2-dimethyl-N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S/c1-5-7-13(20)17-11-8-6-9-12(10-11)18-15(22)19-14(21)16(2,3)4/h6,8-10H,5,7H2,1-4H3,(H,17,20)(H2,18,19,21,22)