2-[(6-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenyl-ethanamide

Systemtic Name: 2-[(6-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenyl-ethanamide Openeye Name: 2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: 2-[(6-chloro-1,3-benzoxazol-2-yl)thio]-N-(2-cyanoethyl)-N-phenylacetamide IUPAC Name: 2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-[(6-chloro-1,3-benzoxazol-2-yl)thio]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C18H14ClN3O2S MolecularWeight: 371.84066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=C(O2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=C(O2)C=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3O2S/c19-13-7-8-15-16(11-13)24-18(21-15)25-12-17(23)22(10-4-9-20)14-5-2-1-3-6-14/h1-3,5-8,11H,4,10,12H2