N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]pentanamide CAS Name: N-[[2-chloro-5-(1-oxopropylamino)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]pentanamide Traditional Name: N-[(2-chloro-5-propionamido-phenyl)thiocarbamoyl]valeramide Formula: C15H20ClN3O2S MolecularWeight: 341.8562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClN3O2S/c1-3-5-6-14(21)19-15(22)18-12-9-10(7-8-11(12)16)17-13(20)4-2/h7-9H,3-6H2,1-2H3,(H,17,20)(H2,18,19,21,22)