5-bromanyl-2-phenethyloxy-N-[[(2-phenylmethoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-phenethyloxy-N-[[(2-phenylmethoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(2-benzyloxybenzoyl)amino]carbamothioyl]-5-bromo-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[[[oxo-(2-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-2-phenethyloxy-N-[[(2-phenylmethoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: N-[[(2-benzoxybenzoyl)amino]thiocarbamoyl]-5-bromo-2-phenethyloxy-benzamide Formula: C30H26BrN3O4S MolecularWeight: 604.51414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C30H26BrN3O4S/c31-23-15-16-27(37-18-17-21-9-3-1-4-10-21)25(19-23)28(35)32-30(39)34-33-29(36)24-13-7-8-14-26(24)38-20-22-11-5-2-6-12-22/h1-16,19H,17-18,20H2,(H,33,36)(H2,32,34,35,39)