(2-nitro-4-piperidin-1-ylsulfonyl-phenyl) N,N-dimethylcarbamodithioate

Systemtic Name: (2-nitro-4-piperidin-1-ylsulfonyl-phenyl) N,N-dimethylcarbamodithioate Openeye Name: [2-nitro-4-(1-piperidylsulfonyl)phenyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-nitro-4-(1-piperidinylsulfonyl)phenyl] ester IUPAC Name: (2-nitro-4-piperidin-1-ylsulfonylphenyl) N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid (2-nitro-4-piperidinosulfonyl-phenyl) ester Formula: C14H19N3O4S3 MolecularWeight: 389.51336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)SC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4S3/c1-15(2)14(22)23-13-7-6-11(10-12(13)17(18)19)24(20,21)16-8-4-3-5-9-16/h6-7,10H,3-5,8-9H2,1-2H3