2-(4-tert-butylphenoxy)-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]acetamide Formula: C22H22ClN3O3S2 MolecularWeight: 476.01138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O3S2/c1-22(2,3)13-8-10-14(11-9-13)29-12-17(27)24-21(30)26-25-20(28)19-18(23)15-6-4-5-7-16(15)31-19/h4-11H,12H2,1-3H3,(H,25,28)(H2,24,26,27,30)