N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: N-[[2-chloro-5-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-phenylprop-2-enamide Traditional Name: N-[(2-chloro-5-propionamido-phenyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C=CC2=CC=CC=C2

InChI

InChI=1S/C19H18ClN3O2S/c1-2-17(24)21-14-9-10-15(20)16(12-14)22-19(26)23-18(25)11-8-13-6-4-3-5-7-13/h3-12H,2H2,1H3,(H,21,24)(H2,22,23,25,26)