2-bromanyl-N-[2-(diphenylmethyl)sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 2-bromanyl-N-[2-(diphenylmethyl)sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-(2-benzhydrylsulfanyl-1,3-benzothiazol-6-yl)-2-bromo-benzamide CAS Name: 2-bromo-N-[2-[(diphenylmethyl)thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-(2-benzhydrylsulfanyl-1,3-benzothiazol-6-yl)-2-bromobenzamide Traditional Name: N-[2-(benzhydrylthio)-1,3-benzothiazol-6-yl]-2-bromo-benzamide Formula: C27H19BrN2OS2 MolecularWeight: 531.48656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=CC=C5Br

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C27H19BrN2OS2/c28-22-14-8-7-13-21(22)26(31)29-20-15-16-23-24(17-20)32-27(30-23)33-25(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17,25H,(H,29,31)