2-cyano-N,N-dimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-imidazole-1-sulfonamide

Systemtic Name: 2-cyano-N,N-dimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-imidazole-1-sulfonamide Openeye Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-2-cyano-N,N-dimethyl-imidazole-1-sulfonamide CAS Name: 2-cyano-N,N-dimethyl-4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-1-imidazolesulfonamide IUPAC Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-2-cyano-N,N-dimethylimidazole-1-sulfonamide Traditional Name: 4-(4-benzylpiperazino)sulfonyl-2-cyano-N,N-dimethyl-imidazole-1-sulfonamide Formula: C17H22N6O4S2 MolecularWeight: 438.52438

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1C=C(N=C1C#N)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)N1C=C(N=C1C#N)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N6O4S2/c1-20(2)29(26,27)23-14-17(19-16(23)12-18)28(24,25)22-10-8-21(9-11-22)13-15-6-4-3-5-7-15/h3-7,14H,8-11,13H2,1-2H3