3-bromanyl-N-[(5-chloranyl-2-methyl-phenyl)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(5-chloranyl-2-methyl-phenyl)carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[(5-chloro-2-methyl-phenyl)carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[(5-chloro-2-methylanilino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[(5-chloro-2-methylphenyl)carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[(5-chloro-2-methyl-phenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C18H18BrClN2O2S MolecularWeight: 441.76972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrClN2O2S/c1-3-8-24-16-7-5-12(9-14(16)19)17(23)22-18(25)21-15-10-13(20)6-4-11(15)2/h4-7,9-10H,3,8H2,1-2H3,(H2,21,22,23,25)