actinium; [8-[[2-methyl-5-(phenylsulfonylamino)phenyl]carbamoyl]-1,2-dithionan-4-yl]azanide

Systemtic Name: actinium; [8-[[2-methyl-5-(phenylsulfonylamino)phenyl]carbamoyl]-1,2-dithionan-4-yl]azanide Openeye Name: actinium; [8-[[5-(benzenesulfonamido)-2-methyl-phenyl]carbamoyl]dithionan-4-yl]azanide CAS Name: actinium; [8-[[5-(benzenesulfonamido)-2-methylanilino]-oxomethyl]-4-dithionanyl]azanide IUPAC Name: actinium; [8-[[5-(benzenesulfonamido)-2-methylphenyl]carbamoyl]dithionan-4-yl]azanide Traditional Name: actinium; [8-[[5-(benzenesulfonamido)-2-methyl-phenyl]carbamoyl]dithionan-4-yl]azanide Formula: C21H26AcN3O3S3- MolecularWeight: 691.672187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)C3CCCC(CSSC3)[NH-].[Ac]

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)C3CCCC(CSSC3)[NH-].[Ac]

InChI

InChI=1S/C21H26N3O3S3.Ac/c1-15-10-11-18(24-30(26,27)19-8-3-2-4-9-19)12-20(15)23-21(25)16-6-5-7-17(22)14-29-28-13-16;/h2-4,8-12,16-17,22,24H,5-7,13-14H2,1H3,(H,23,25);/q-1;