4-chloranyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-4-chloro-benzamide CAS Name: 4-chloro-N-[2-(phenylmethylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-4-chlorobenzamide Traditional Name: N-[2-(benzylthio)-1,3-benzothiazol-6-yl]-4-chloro-benzamide Formula: C21H15ClN2OS2 MolecularWeight: 410.9396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN2OS2/c22-16-8-6-15(7-9-16)20(25)23-17-10-11-18-19(12-17)27-21(24-18)26-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,23,25)