2-(4-tert-butylphenoxy)-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]acetamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S2/c1-20(2,3)12-4-7-14(8-5-12)26-11-17(25)23-18(27)24-19-22-15-9-6-13(21)10-16(15)28-19/h4-10H,11H2,1-3H3,(H2,22,23,24,25,27)