3-phenyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: 3-phenyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Openeye Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-3-phenyl-propanamide CAS Name: 3-phenyl-N-[2-(phenylmethylthio)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylpropanamide Traditional Name: N-[2-(benzylthio)-1,3-benzothiazol-6-yl]-3-phenyl-propionamide Formula: C23H20N2OS2 MolecularWeight: 404.5477

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2OS2/c26-22(14-11-17-7-3-1-4-8-17)24-19-12-13-20-21(15-19)28-23(25-20)27-16-18-9-5-2-6-10-18/h1-10,12-13,15H,11,14,16H2,(H,24,26)