N-[4-chloranyl-3-(propanoylcarbamothioylamino)phenyl]propanamide

Systemtic Name: N-[4-chloranyl-3-(propanoylcarbamothioylamino)phenyl]propanamide Openeye Name: N-[4-chloro-3-(propanoylcarbamothioylamino)phenyl]propanamide CAS Name: N-[4-chloro-3-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: N-[4-chloro-3-(propanoylcarbamothioylamino)phenyl]propanamide Traditional Name: N-[4-chloro-3-(propionylthiocarbamoylamino)phenyl]propionamide Formula: C13H16ClN3O2S MolecularWeight: 313.80304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3O2S/c1-3-11(18)15-8-5-6-9(14)10(7-8)16-13(20)17-12(19)4-2/h5-7H,3-4H2,1-2H3,(H,15,18)(H2,16,17,19,20)