1-[[3-azanyl-3-(2-sulfosulfanylethylimino)propyl]sulfamoyl]-4-methyl-benzene

Systemtic Name: 1-[[3-azanyl-3-(2-sulfosulfanylethylimino)propyl]sulfamoyl]-4-methyl-benzene Openeye Name: 1-[[3-amino-3-(2-sulfosulfanylethylimino)propyl]sulfamoyl]-4-methyl-benzene CAS Name: 1-[[3-amino-3-[2-(sulfothio)ethylimino]propyl]sulfamoyl]-4-methylbenzene IUPAC Name: 1-[[3-amino-3-(2-sulfosulfanylethylimino)propyl]sulfamoyl]-4-methylbenzene Traditional Name: 1-[[3-amino-3-[2-(sulfothio)ethylimino]propyl]sulfamoyl]-4-methyl-benzene Formula: C12H19N3O5S3 MolecularWeight: 381.49136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=NCCSS(=O)(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=NCCSS(=O)(=O)O)N

InChI

InChI=1S/C12H19N3O5S3/c1-10-2-4-11(5-3-10)22(16,17)15-7-6-12(13)14-8-9-21-23(18,19)20/h2-5,15H,6-9H2,1H3,(H2,13,14)(H,18,19,20)