3-bromanyl-4-phenethyloxy-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[3-(2-phenylethanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[3-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-[[3-[(2-phenylacetyl)amino]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-[[3-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]benzamide Formula: C30H26BrN3O3S MolecularWeight: 588.51474

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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)NC(=O)CC4=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)NC(=O)CC4=CC=CC=C4)Br

InChI

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