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

Systemtic Name: N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-cyclohexylphenoxy)ethanamide Openeye Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-cyclohexylphenoxy)acetamide CAS Name: N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(4-cyclohexylphenoxy)acetamide IUPAC Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-cyclohexylphenoxy)acetamide Traditional Name: N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(4-cyclohexylphenoxy)acetamide Formula: C22H22ClN3O2S2 MolecularWeight: 460.01198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2S2/c23-16-8-11-18-19(12-16)30-22(24-18)26-21(29)25-20(27)13-28-17-9-6-15(7-10-17)14-4-2-1-3-5-14/h6-12,14H,1-5,13H2,(H2,24,25,26,27,29)