N-(2-cyanoethyl)-2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(4,5-diphenyloxazol-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4,5-diphenyl-2-oxazolyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4,5-diphenyloxazol-2-yl)thio]-N-phenyl-acetamide Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O2S/c27-17-10-18-29(22-15-8-3-9-16-22)23(30)19-32-26-28-24(20-11-4-1-5-12-20)25(31-26)21-13-6-2-7-14-21/h1-9,11-16H,10,18-19H2