N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[(4-acetamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[(4-acetamidobenzoyl)amino]thiocarbamoyl]-3-methyl-butyramide Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O3S/c1-9(2)8-13(21)17-15(23)19-18-14(22)11-4-6-12(7-5-11)16-10(3)20/h4-7,9H,8H2,1-3H3,(H,16,20)(H,18,22)(H2,17,19,21,23)