5-bromanyl-N-[(4-methylphenyl)carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[(4-methylphenyl)carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-2-propoxy-N-(p-tolylcarbamothioyl)benzamide CAS Name: 5-bromo-N-[(4-methylanilino)-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[(4-methylphenyl)carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-2-propoxy-N-(p-tolylthiocarbamoyl)benzamide Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O2S/c1-3-10-23-16-9-6-13(19)11-15(16)17(22)21-18(24)20-14-7-4-12(2)5-8-14/h4-9,11H,3,10H2,1-2H3,(H2,20,21,22,24)