4-[2-[4,6-bis(oxidanylidene)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-[2-[4,6-bis(oxidanylidene)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzenesulfonic acid Openeye Name: 4-[2-(1-allyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]benzenesulfonic acid CAS Name: 4-[2-(4,6-dioxo-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 4-[2-(4,6-dioxo-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 4-[N'-(1-allyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]besylic acid Formula: C13H12N4O5S2 MolecularWeight: 368.38818

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=NNC2=CC=C(C=C2)S(=O)(=O)O)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)C(=NNC2=CC=C(C=C2)S(=O)(=O)O)C(=O)NC1=S

InChI

InChI=1S/C13H12N4O5S2/c1-2-7-17-12(19)10(11(18)14-13(17)23)16-15-8-3-5-9(6-4-8)24(20,21)22/h2-6,15H,1,7H2,(H,14,18,23)(H,20,21,22)