(3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C14H12N4O3S MolecularWeight: 316.33508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)COC(=O)CSC2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CC1=NOC(=N1)COC(=O)CSC2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C14H12N4O3S/c1-9-16-12(21-18-9)7-20-14(19)8-22-13-6-15-10-4-2-3-5-11(10)17-13/h2-6H,7-8H2,1H3