5-bromanyl-2-phenethyloxy-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-phenethyloxy-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 5-bromo-2-phenethyloxy-N-[(thiophene-2-carbonylamino)carbamothioyl]benzamide CAS Name: 5-bromo-N-[[[oxo(thiophen-2-yl)methyl]hydrazo]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-2-phenethyloxy-N-[(thiophene-2-carbonylamino)carbamothioyl]benzamide Traditional Name: 5-bromo-2-phenethyloxy-N-[(2-thenoylamino)thiocarbamoyl]benzamide Formula: C21H18BrN3O3S2 MolecularWeight: 504.41992

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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=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18BrN3O3S2/c22-15-8-9-17(28-11-10-14-5-2-1-3-6-14)16(13-15)19(26)23-21(29)25-24-20(27)18-7-4-12-30-18/h1-9,12-13H,10-11H2,(H,24,27)(H2,23,25,26,29)