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

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-phenyl-ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-cyanoethyl)-N-phenylacetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H15N3O2S/c19-11-6-12-21(14-7-2-1-3-8-14)17(22)13-24-18-20-15-9-4-5-10-16(15)23-18/h1-5,7-10H,6,12-13H2