2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C18H16BrN3O3S MolecularWeight: 434.30694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H16BrN3O3S/c1-11-8-12(19)6-7-13(11)21-16(23)9-20-17(24)10-26-18-22-14-4-2-3-5-15(14)25-18/h2-8H,9-10H2,1H3,(H,20,24)(H,21,23)