3-bromanyl-N-[(4-butoxyphenyl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4-butoxyphenyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(4-butoxyphenyl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[(4-butoxyanilino)-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(4-butoxyphenyl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(4-butoxyphenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

InChI

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