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

Systemtic Name: sodium 1-(methylamino)-1,4-bis(oxidanylidene)-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butane-2-sulfonate Openeye Name: sodium 4-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-1-(methylamino)-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 1-(methylamino)-1,4-dioxo-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]-2-butanesulfonate IUPAC Name: sodium 1-(methylamino)-1,4-dioxo-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butane-2-sulfonate Traditional Name: sodium 4-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-1,4-diketo-1-(methylamino)butane-2-sulfonate Formula: C10H15N4NaO5S2 MolecularWeight: 358.36967

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)CC(C(=O)NC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)CC(C(=O)NC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H16N4O5S2.Na/c1-5(2)9-13-14-10(20-9)12-7(15)4-6(8(16)11-3)21(17,18)19;/h5-6H,4H2,1-3H3,(H,11,16)(H,12,14,15)(H,17,18,19);/q;+1/p-1