3-bromanyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[3-(propanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[3-(propanoylamino)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[(3-propionamidophenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O3S/c1-3-10-27-17-9-8-13(11-16(17)21)19(26)24-20(28)23-15-7-5-6-14(12-15)22-18(25)4-2/h5-9,11-12H,3-4,10H2,1-2H3,(H,22,25)(H2,23,24,26,28)