4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxo-butane-2-sulfonic acid CAS Name: 4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methoxy-1,4-dioxobutane-2-sulfonic acid Traditional Name: 4-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1,4-diketo-1-methoxy-butane-2-sulfonic acid Formula: C11H17N3O6S2 MolecularWeight: 351.39918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)CC(C(=O)OC)S(=O)(=O)O

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)CC(C(=O)OC)S(=O)(=O)O

InChI

InChI=1S/C11H17N3O6S2/c1-3-4-5-9-13-14-11(21-9)12-8(15)6-7(10(16)20-2)22(17,18)19/h7H,3-6H2,1-2H3,(H,12,14,15)(H,17,18,19)