2-bromanyl-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 2-bromanyl-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 2-bromo-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide CAS Name: 2-bromo-N-[2-[(3,4-dichlorophenyl)methylthio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 2-bromo-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 2-bromo-N-[2-[(3,4-dichlorobenzyl)thio]-1,3-benzothiazol-6-yl]benzamide Formula: C21H13BrCl2N2OS2 MolecularWeight: 524.28072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13BrCl2N2OS2/c22-15-4-2-1-3-14(15)20(27)25-13-6-8-18-19(10-13)29-21(26-18)28-11-12-5-7-16(23)17(24)9-12/h1-10H,11H2,(H,25,27)