2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-(4-fluorophenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide Formula: C18H14FN3O2S MolecularWeight: 355.386063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)N(CCC#N)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)N(CCC#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FN3O2S/c19-13-6-8-14(9-7-13)22(11-3-10-20)17(23)12-25-18-21-15-4-1-2-5-16(15)24-18/h1-2,4-9H,3,11-12H2