N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(4-thiazolylmethylthio)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(thiazol-4-ylmethylthio)benzamide Formula: C24H17N3OS3 MolecularWeight: 459.60628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)SCC5=CSC=N5

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)SCC5=CSC=N5

InChI

InChI=1S/C24H17N3OS3/c28-23(19-8-1-3-10-21(19)30-14-18-13-29-15-25-18)26-17-7-5-6-16(12-17)24-27-20-9-2-4-11-22(20)31-24/h1-13,15H,14H2,(H,26,28)