5-bromanyl-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]carbamothioyl]-2-isopropoxy-benzamide CAS Name: 5-bromo-N-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]-2-isopropoxy-benzamide Formula: C20H17BrClN3O3S2 MolecularWeight: 526.85428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H17BrClN3O3S2/c1-10(2)28-14-8-7-11(21)9-13(14)18(26)23-20(29)25-24-19(27)17-16(22)12-5-3-4-6-15(12)30-17/h3-10H,1-2H3,(H,24,27)(H2,23,25,26,29)