1-azanyl-1-[6-(3-methylpyridin-2-yl)-1,7-naphthyridin-8-yl]-3-oxidanylidene-2-sulfamoyl-butane-2-sulfonic acid

Systemtic Name: 1-azanyl-1-[6-(3-methylpyridin-2-yl)-1,7-naphthyridin-8-yl]-3-oxidanylidene-2-sulfamoyl-butane-2-sulfonic acid Openeye Name: 1-amino-1-[6-(3-methyl-2-pyridyl)-1,7-naphthyridin-8-yl]-3-oxo-2-sulfamoyl-butane-2-sulfonic acid CAS Name: 1-amino-1-[6-(3-methyl-2-pyridinyl)-1,7-naphthyridin-8-yl]-3-oxo-2-sulfamoyl-2-butanesulfonic acid IUPAC Name: 1-amino-1-[6-(3-methylpyridin-2-yl)-1,7-naphthyridin-8-yl]-3-oxo-2-sulfamoylbutane-2-sulfonic acid Traditional Name: 1-amino-3-keto-1-[6-(3-methyl-2-pyridyl)-1,7-naphthyridin-8-yl]-2-sulfamoyl-butane-2-sulfonic acid Formula: C18H19N5O6S2 MolecularWeight: 465.50336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2=NC(=C3C(=C2)C=CC=N3)C(C(C(=O)C)(S(=O)(=O)N)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(N=CC=C1)C2=NC(=C3C(=C2)C=CC=N3)C(C(C(=O)C)(S(=O)(=O)N)S(=O)(=O)O)N

InChI

InChI=1S/C18H19N5O6S2/c1-10-5-3-7-21-14(10)13-9-12-6-4-8-22-15(12)16(23-13)17(19)18(11(2)24,30(20,25)26)31(27,28)29/h3-9,17H,19H2,1-2H3,(H2,20,25,26)(H,27,28,29)