5-bromanyl-N-[(3-ethoxyphenyl)carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[(3-ethoxyphenyl)carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[(3-ethoxyphenyl)carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[(3-ethoxyanilino)-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[(3-ethoxyphenyl)carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-(m-phenetylthiocarbamoyl)-2-propoxy-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O3S/c1-3-10-25-17-9-8-13(20)11-16(17)18(23)22-19(26)21-14-6-5-7-15(12-14)24-4-2/h5-9,11-12H,3-4,10H2,1-2H3,(H2,21,22,23,26)