1,5-dimethyl-3-sulfanylidene-4-[2-[(3-sulfinatosulfanylphenyl)carbonylamino]ethyl]-1,2,4-triazolidine

Systemtic Name: 1,5-dimethyl-3-sulfanylidene-4-[2-[(3-sulfinatosulfanylphenyl)carbonylamino]ethyl]-1,2,4-triazolidine Openeye Name: 1,5-dimethyl-4-[2-[(3-sulfinatosulfanylbenzoyl)amino]ethyl]-3-thioxo-1,2,4-triazolidine CAS Name: 1,5-dimethyl-4-[2-[[oxo-[3-(sulfinatothio)phenyl]methyl]amino]ethyl]-3-sulfanylidene-1,2,4-triazolidine IUPAC Name: 1,5-dimethyl-3-sulfanylidene-4-[2-[(3-sulfinatosulfanylbenzoyl)amino]ethyl]-1,2,4-triazolidine Traditional Name: 1,5-dimethyl-4-[2-[[3-(sulfinatothio)benzoyl]amino]ethyl]-3-thioxo-1,2,4-triazolidine Formula: C13H17N4O3S3- MolecularWeight: 373.49408

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(NC(=S)N1CCNC(=O)C2=CC(=CC=C2)SS(=O)[O-])C

Isomeric SMILES

CC1N(NC(=S)N1CCNC(=O)C2=CC(=CC=C2)SS(=O)[O-])C

InChI

InChI=1S/C13H18N4O3S3/c1-9-16(2)15-13(21)17(9)7-6-14-12(18)10-4-3-5-11(8-10)22-23(19)20/h3-5,8-9H,6-7H2,1-2H3,(H,14,18)(H,15,21)(H,19,20)/p-1