7-[[5-[(5-azanyl-2-methyl-pyrazol-3-yl)carbonylamino]-2-methyl-pyrazol-3-yl]carbonylamino]naphthalene-1,3-disulfonic acid

Systemtic Name: 7-[[5-[(5-azanyl-2-methyl-pyrazol-3-yl)carbonylamino]-2-methyl-pyrazol-3-yl]carbonylamino]naphthalene-1,3-disulfonic acid Openeye Name: 7-[[5-[(5-amino-2-methyl-pyrazole-3-carbonyl)amino]-2-methyl-pyrazole-3-carbonyl]amino]naphthalene-1,3-disulfonic acid CAS Name: 7-[[[5-[[(5-amino-2-methyl-3-pyrazolyl)-oxomethyl]amino]-2-methyl-3-pyrazolyl]-oxomethyl]amino]naphthalene-1,3-disulfonic acid IUPAC Name: 7-[[5-[(5-amino-2-methylpyrazole-3-carbonyl)amino]-2-methylpyrazole-3-carbonyl]amino]naphthalene-1,3-disulfonic acid Traditional Name: 7-[[5-[(5-amino-2-methyl-pyrazole-3-carbonyl)amino]-2-methyl-pyrazole-3-carbonyl]amino]naphthalene-1,3-disulfonic acid Formula: C20H19N7O8S2 MolecularWeight: 549.53696

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)N)C(=O)NC2=NN(C(=C2)C(=O)NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)O)C

Isomeric SMILES

CN1C(=CC(=N1)N)C(=O)NC2=NN(C(=C2)C(=O)NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)O)C

InChI

InChI=1S/C20H19N7O8S2/c1-26-14(8-17(21)24-26)20(29)23-18-9-15(27(2)25-18)19(28)22-11-4-3-10-5-12(36(30,31)32)7-16(13(10)6-11)37(33,34)35/h3-9H,1-2H3,(H2,21,24)(H,22,28)(H,23,25,29)(H,30,31,32)(H,33,34,35)