[1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C19H27N3O3S3 MolecularWeight: 441.63098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC(=S)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC(=S)N3CCCC3

InChI

InChI=1S/C19H27N3O3S3/c1-15(27-19(26)21-11-5-6-12-21)18(23)20-16-7-9-17(10-8-16)28(24,25)22-13-3-2-4-14-22/h7-10,15H,2-6,11-14H2,1H3,(H,20,23)