N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[2-chloro-5-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(2-chloro-5-propionamido-phenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)CC)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)CC)Cl

InChI

InChI=1S/C20H22ClN3O3S/c1-3-11-27-15-8-5-13(6-9-15)19(26)24-20(28)23-17-12-14(7-10-16(17)21)22-18(25)4-2/h5-10,12H,3-4,11H2,1-2H3,(H,22,25)(H2,23,24,26,28)