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

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-benzyloxy-benzamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-3-benzoxy-benzamide Formula: C28H21N3O2S2 MolecularWeight: 495.61524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C28H21N3O2S2/c32-26(20-11-8-12-21(17-20)33-18-19-9-2-1-3-10-19)31-28(34)30-23-14-5-4-13-22(23)27-29-24-15-6-7-16-25(24)35-27/h1-17H,18H2,(H2,30,31,32,34)