N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C22H16ClN3O2S2 MolecularWeight: 453.96434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3O2S2/c23-16-9-10-18-19(12-16)30-22(24-18)26-21(29)25-20(27)15-7-4-8-17(11-15)28-13-14-5-2-1-3-6-14/h1-12H,13H2,(H2,24,25,26,27,29)