N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[[oxo-[4-(1-oxobutylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[(4-butyramidobenzoyl)amino]thiocarbamoyl]cyclopropanecarboxamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2CC2

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2CC2

InChI

InChI=1S/C16H20N4O3S/c1-2-3-13(21)17-12-8-6-11(7-9-12)15(23)19-20-16(24)18-14(22)10-4-5-10/h6-10H,2-5H2,1H3,(H,17,21)(H,19,23)(H2,18,20,22,24)