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

Systemtic Name: 2-bromanyl-N-[2-[(3-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 2-bromo-N-[2-(m-tolylmethylsulfanyl)-1,3-benzothiazol-6-yl]benzamide CAS Name: 2-bromo-N-[2-[(3-methylphenyl)methylthio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 2-bromo-N-[2-[(3-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 2-bromo-N-[2-[(3-methylbenzyl)thio]-1,3-benzothiazol-6-yl]benzamide Formula: C22H17BrN2OS2 MolecularWeight: 469.41718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C22H17BrN2OS2/c1-14-5-4-6-15(11-14)13-27-22-25-19-10-9-16(12-20(19)28-22)24-21(26)17-7-2-3-8-18(17)23/h2-12H,13H2,1H3,(H,24,26)