potassium N-[2-[[4-(phenylsulfonyl)-1H-pyrrol-3-yl]sulfonyl]ethanoylamino]carbamodithioate

Systemtic Name: potassium N-[2-[[4-(phenylsulfonyl)-1H-pyrrol-3-yl]sulfonyl]ethanoylamino]carbamodithioate Openeye Name: potassium N-[[2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]acetyl]amino]carbamodithioate CAS Name: potassium N-[[2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]-1-oxoethyl]amino]carbamodithioate IUPAC Name: potassium N-[[2-[[4-(benzenesulfonyl)-1H-pyrrol-3-yl]sulfonyl]acetyl]amino]carbamodithioate Traditional Name: potassium N-[[2-[(4-besyl-1H-pyrrol-3-yl)sulfonyl]acetyl]amino]carbamodithioate Formula: C13H12KN3O5S4 MolecularWeight: 457.60978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CNC=C2S(=O)(=O)CC(=O)NNC(=S)[S-].[K+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CNC=C2S(=O)(=O)CC(=O)NNC(=S)[S-].[K+]

InChI

InChI=1S/C13H13N3O5S4.K/c17-12(15-16-13(22)23)8-24(18,19)10-6-14-7-11(10)25(20,21)9-4-2-1-3-5-9;/h1-7,14H,8H2,(H,15,17)(H2,16,22,23);/q;+1/p-1