6-azanyl-5-(6-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)naphthalene-2-sulfonic acid

Systemtic Name: 6-azanyl-5-(6-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)naphthalene-2-sulfonic acid Openeye Name: 6-amino-5-(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)naphthalene-2-sulfonic acid CAS Name: 6-amino-5-(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)-2-naphthalenesulfonic acid IUPAC Name: 6-amino-5-(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)naphthalene-2-sulfonic acid Traditional Name: 6-amino-5-(6-fluoro-1,4-dihydro-s-triazin-2-yl)naphthalene-2-sulfonic acid Formula: C13H11FN4O3S MolecularWeight: 322.314843

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(NC(=N1)F)C2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)O)N

Isomeric SMILES

C1N=C(NC(=N1)F)C2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)O)N

InChI

InChI=1S/C13H11FN4O3S/c14-13-17-6-16-12(18-13)11-9-3-2-8(22(19,20)21)5-7(9)1-4-10(11)15/h1-5H,6,15H2,(H,16,17,18)(H,19,20,21)