2,2-dimethyl-N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[[4-(propanoylamino)phenyl]carbonylamino]carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[[oxo-[4-(1-oxopropylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[[4-(propanoylamino)benzoyl]amino]carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[[(4-propionamidobenzoyl)amino]thiocarbamoyl]propionamide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O3S/c1-5-12(21)17-11-8-6-10(7-9-11)13(22)19-20-15(24)18-14(23)16(2,3)4/h6-9H,5H2,1-4H3,(H,17,21)(H,19,22)(H2,18,20,23,24)