N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: N-[[(4,5-dichloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(4,5-dichloro-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C22H15Cl2N3O2S2 MolecularWeight: 488.4094

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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=CC(=C4Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

InChI

InChI=1S/C22H15Cl2N3O2S2/c23-16-9-10-17-19(18(16)24)25-22(31-17)27-21(30)26-20(28)14-7-4-8-15(11-14)29-12-13-5-2-1-3-6-13/h1-11H,12H2,(H2,25,26,27,28,30)