4-[2-[1,3-diethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzenesulfonate

Systemtic Name: 4-[2-[1,3-diethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzenesulfonate Openeye Name: 4-[2-(1,3-diethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]benzenesulfonate CAS Name: 4-[2-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzenesulfonate IUPAC Name: 4-[2-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzenesulfonate Traditional Name: 4-[N'-(1,3-diethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]besylate Formula: C14H15N4O5S2- MolecularWeight: 383.4227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=NNC2=CC=C(C=C2)S(=O)(=O)[O-])C(=O)N(C1=S)CC

Isomeric SMILES

CCN1C(=O)C(=NNC2=CC=C(C=C2)S(=O)(=O)[O-])C(=O)N(C1=S)CC

InChI

InChI=1S/C14H16N4O5S2/c1-3-17-12(19)11(13(20)18(4-2)14(17)24)16-15-9-5-7-10(8-6-9)25(21,22)23/h5-8,15H,3-4H2,1-2H3,(H,21,22,23)/p-1