N,N-diethyl-1-methyl-2-[3-oxidanylidene-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propyl]benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-1-methyl-2-[3-oxidanylidene-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propyl]benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-1-methyl-2-[3-oxo-3-[4-(4-pyridylmethyl)piperazin-1-yl]propyl]benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-1-methyl-2-[3-oxo-3-[4-(pyridin-4-ylmethyl)-1-piperazinyl]propyl]-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-1-methyl-2-[3-oxo-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propyl]benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[3-keto-3-[4-(4-pyridylmethyl)piperazino]propyl]-1-methyl-benzimidazole-5-sulfonamide Formula: C25H34N6O3S MolecularWeight: 498.64086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=O)N3CCN(CC3)CC4=CC=NC=C4)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=O)N3CCN(CC3)CC4=CC=NC=C4)C

InChI

InChI=1S/C25H34N6O3S/c1-4-31(5-2)35(33,34)21-6-7-23-22(18-21)27-24(28(23)3)8-9-25(32)30-16-14-29(15-17-30)19-20-10-12-26-13-11-20/h6-7,10-13,18H,4-5,8-9,14-17,19H2,1-3H3