2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-bromanyl-4-methoxy-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-bromanyl-4-methoxy-phenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-bromo-4-methoxy-phenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-bromo-4-methoxyphenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-bromo-4-methoxyphenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-bromo-4-methoxy-phenyl)acetamide Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3O2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3O2)Br

InChI

InChI=1S/C16H13BrN2O3S/c1-21-13-7-6-10(8-11(13)17)18-15(20)9-23-16-19-12-4-2-3-5-14(12)22-16/h2-8H,9H2,1H3,(H,18,20)