N-(4-azanylbutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide

Systemtic Name: N-(4-azanylbutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide Openeye Name: N-(4-aminobutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide CAS Name: N-(4-aminobutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide IUPAC Name: N-(4-aminobutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide Traditional Name: N-(4-aminobutyl)-4-[[1-(1H-imidazol-2-yl)ethyl-(1H-imidazol-2-ylmethyl)amino]methyl]benzenesulfonamide Formula: C20H29N7O2S MolecularWeight: 431.55496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CN1)N(CC2=CC=C(C=C2)S(=O)(=O)NCCCCN)CC3=NC=CN3

Isomeric SMILES

CC(C1=NC=CN1)N(CC2=CC=C(C=C2)S(=O)(=O)NCCCCN)CC3=NC=CN3

InChI

InChI=1S/C20H29N7O2S/c1-16(20-24-12-13-25-20)27(15-19-22-10-11-23-19)14-17-4-6-18(7-5-17)30(28,29)26-9-3-2-8-21/h4-7,10-13,16,26H,2-3,8-9,14-15,21H2,1H3,(H,22,23)(H,24,25)