N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C16H17N3O2S/c1-11-15(12(2)21-19-11)16(20)18-7-8-22-10-14-6-4-3-5-13(14)9-17/h3-6H,7-8,10H2,1-2H3,(H,18,20)