2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(5-bromo-2-methoxy-benzyl)-N-methyl-acetamide Formula: C18H17BrN2O2S2 MolecularWeight: 437.37378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN2O2S2/c1-21(10-12-9-13(19)7-8-15(12)23-2)17(22)11-24-18-20-14-5-3-4-6-16(14)25-18/h3-9H,10-11H2,1-2H3