sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-bis(oxidanylidene)butane-2-sulfonate

Systemtic Name: sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-bis(oxidanylidene)butane-2-sulfonate Openeye Name: sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxo-2-butanesulfonate IUPAC Name: sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxobutane-2-sulfonate Traditional Name: sodium 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1,4-diketo-1-methoxy-butane-2-sulfonate Formula: C9H12N3NaO6S2 MolecularWeight: 345.32785

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)CC(C(=O)OC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)CC(C(=O)OC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C9H13N3O6S2.Na/c1-3-7-11-12-9(19-7)10-6(13)4-5(8(14)18-2)20(15,16)17;/h5H,3-4H2,1-2H3,(H,10,12,13)(H,15,16,17);/q;+1/p-1