sodium 2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]benzenesulfonate

Systemtic Name: sodium 2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]benzenesulfonate Openeye Name: sodium 2-[(E)-(cyclohexylcarbamothioylhydrazono)methyl]benzenesulfonate CAS Name: sodium 2-[(E)-[[(cyclohexylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzenesulfonate IUPAC Name: sodium 2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]benzenesulfonate Traditional Name: sodium 2-[(E)-(cyclohexylthiocarbamoylhydrazono)methyl]besylate Formula: C14H18N3NaO3S2 MolecularWeight: 363.43079

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN=CC2=CC=CC=C2S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1CCC(CC1)NC(=S)N/N=C/C2=CC=CC=C2S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H19N3O3S2.Na/c18-22(19,20)13-9-5-4-6-11(13)10-15-17-14(21)16-12-7-2-1-3-8-12;/h4-6,9-10,12H,1-3,7-8H2,(H2,16,17,21)(H,18,19,20);/q;+1/p-1/b15-10+;