N,N,1-trimethyl-2-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzimidazole-5-carboxamide

Systemtic Name: N,N,1-trimethyl-2-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzimidazole-5-carboxamide Openeye Name: 2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N,N,1-trimethyl-benzimidazole-5-carboxamide CAS Name: 2-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N,N,1-trimethyl-5-benzimidazolecarboxamide IUPAC Name: 2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N,N,1-trimethylbenzimidazole-5-carboxamide Traditional Name: 2-[(4-besylpiperazino)methyl]-N,N,1-trimethyl-benzimidazole-5-carboxamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N(C)C)N=C1CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N(C)C)N=C1CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H27N5O3S/c1-24(2)22(28)17-9-10-20-19(15-17)23-21(25(20)3)16-26-11-13-27(14-12-26)31(29,30)18-7-5-4-6-8-18/h4-10,15H,11-14,16H2,1-3H3