2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-bromanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C16H13BrN2OS2 MolecularWeight: 393.32122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13BrN2OS2/c1-10-8-11(17)6-7-12(10)18-15(20)9-21-16-19-13-4-2-3-5-14(13)22-16/h2-8H,9H2,1H3,(H,18,20)