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

Systemtic Name: N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-ethylphenoxy)ethanamide Openeye Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-ethylphenoxy)acetamide CAS Name: N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(4-ethylphenoxy)acetamide IUPAC Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-ethylphenoxy)acetamide Traditional Name: N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(4-ethylphenoxy)acetamide Formula: C18H16ClN3O2S2 MolecularWeight: 405.92154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O2S2/c1-2-11-3-6-13(7-4-11)24-10-16(23)21-17(25)22-18-20-14-8-5-12(19)9-15(14)26-18/h3-9H,2,10H2,1H3,(H2,20,21,22,23,25)