3-bromanyl-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]-4-ethoxy-benzamide Formula: C19H15BrClN3O3S2 MolecularWeight: 512.8277

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

InChI

InChI=1S/C19H15BrClN3O3S2/c1-2-27-13-8-7-10(9-12(13)20)17(25)22-19(28)24-23-18(26)16-15(21)11-5-3-4-6-14(11)29-16/h3-9H,2H2,1H3,(H,23,26)(H2,22,24,25,28)