[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C16H23N3O3S3 MolecularWeight: 401.56712

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CN(C)C(=S)SCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C16H23N3O3S3/c1-18(2)16(23)24-12-15(20)17-13-7-6-8-14(11-13)25(21,22)19-9-4-3-5-10-19/h6-8,11H,3-5,9-10,12H2,1-2H3,(H,17,20)