3-bromanyl-4-butoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-butoxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-3-bromo-4-butoxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-butoxybenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-3-bromo-4-butoxy-benzamide Formula: C24H24BrN3O2S MolecularWeight: 498.43526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C24H24BrN3O2S/c1-2-3-15-30-22-14-9-17(16-21(22)25)23(29)28-24(31)27-20-12-10-19(11-13-20)26-18-7-5-4-6-8-18/h4-14,16,26H,2-3,15H2,1H3,(H2,27,28,29,31)