N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-phenylmethoxy-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-phenylmethoxy-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-benzyloxy-benzamide CAS Name: N-[(1,3-benzothiazol-2-ylamino)-sulfanylidenemethyl]-4-phenylmethoxybenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-phenylmethoxybenzamide Traditional Name: N-(1,3-benzothiazol-2-ylthiocarbamoyl)-4-benzoxy-benzamide Formula: C22H17N3O2S2 MolecularWeight: 419.51928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H17N3O2S2/c26-20(24-21(28)25-22-23-18-8-4-5-9-19(18)29-22)16-10-12-17(13-11-16)27-14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,23,24,25,26,28)