[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C21H17N3O2S2 MolecularWeight: 407.50858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CSC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CSC3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H17N3O2S2/c1-14-6-8-15(9-7-14)21-23-16(12-28-21)11-26-20(25)13-27-19-10-22-17-4-2-3-5-18(17)24-19/h2-10,12H,11,13H2,1H3