4-[[5,6-bis(fluoranyl)-1,2,3-triazin-4-yl]amino]-3-methyl-benzenesulfonic acid

Systemtic Name: 4-[[5,6-bis(fluoranyl)-1,2,3-triazin-4-yl]amino]-3-methyl-benzenesulfonic acid Openeye Name: 4-[(5,6-difluorotriazin-4-yl)amino]-3-methyl-benzenesulfonic acid CAS Name: 4-[(5,6-difluoro-4-triazinyl)amino]-3-methylbenzenesulfonic acid IUPAC Name: 4-[(5,6-difluorotriazin-4-yl)amino]-3-methylbenzenesulfonic acid Traditional Name: 4-[(5,6-difluorotriazin-4-yl)amino]-3-methyl-besylic acid Formula: C10H8F2N4O3S MolecularWeight: 302.257326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)NC2=C(C(=NN=N2)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)NC2=C(C(=NN=N2)F)F

InChI

InChI=1S/C10H8F2N4O3S/c1-5-4-6(20(17,18)19)2-3-7(5)13-10-8(11)9(12)14-16-15-10/h2-4H,1H3,(H,13,14,15)(H,17,18,19)