2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(trifluoromethyl)quinoxaline-6-carboxylic acid

Systemtic Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(trifluoromethyl)quinoxaline-6-carboxylic acid Openeye Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(trifluoromethyl)quinoxaline-6-carboxylic acid CAS Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-(trifluoromethyl)-6-quinoxalinecarboxylic acid IUPAC Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(trifluoromethyl)quinoxaline-6-carboxylic acid Traditional Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-(trifluoromethyl)quinoxaline-6-carboxylic acid Formula: C13H7F3N4O2S2 MolecularWeight: 372.34549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC2=NC3=C(C=C(C=C3)C(=O)O)N=C2C(F)(F)F

Isomeric SMILES

CC1=NN=C(S1)SC2=NC3=C(C=C(C=C3)C(=O)O)N=C2C(F)(F)F

InChI

InChI=1S/C13H7F3N4O2S2/c1-5-19-20-12(23-5)24-10-9(13(14,15)16)17-8-4-6(11(21)22)2-3-7(8)18-10/h2-4H,1H3,(H,21,22)