4-[2-(2-cyanophenyl)sulfanylphenyl]carbonyl-N,N-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[2-(2-cyanophenyl)sulfanylphenyl]carbonyl-N,N-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[2-(2-cyanophenyl)sulfanylbenzoyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]-N,N-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[2-(2-cyanophenyl)sulfanylbenzoyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[2-[(2-cyanophenyl)thio]benzoyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C20H22N4O3S2/c1-22(2)29(26,27)24-13-11-23(12-14-24)20(25)17-8-4-6-10-19(17)28-18-9-5-3-7-16(18)15-21/h3-10H,11-14H2,1-2H3