3-bromanyl-4-phenethyloxy-N-[[3-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[3-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-3-bromo-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[[3-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-3-bromo-4-phenethyloxybenzamide Traditional Name: N-[[3-(benzylcarbamoyl)phenyl]thiocarbamoyl]-3-bromo-4-phenethyloxy-benzamide Formula: C30H26BrN3O3S MolecularWeight: 588.51474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4)Br

InChI

InChI=1S/C30H26BrN3O3S/c31-26-19-24(14-15-27(26)37-17-16-21-8-3-1-4-9-21)29(36)34-30(38)33-25-13-7-12-23(18-25)28(35)32-20-22-10-5-2-6-11-22/h1-15,18-19H,16-17,20H2,(H,32,35)(H2,33,34,36,38)