4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide

Systemtic Name: 4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide Openeye Name: 4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide CAS Name: 4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide IUPAC Name: 4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide Traditional Name: 4-[[4-(dipropylamino)butylamino]methyl]-N,N-bis(1H-imidazol-2-ylmethyl)benzenesulfonamide Formula: C25H39N7O2S MolecularWeight: 501.68786

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCCNCC1=CC=C(C=C1)S(=O)(=O)N(CC2=NC=CN2)CC3=NC=CN3

Isomeric SMILES

CCCN(CCC)CCCCNCC1=CC=C(C=C1)S(=O)(=O)N(CC2=NC=CN2)CC3=NC=CN3

InChI

InChI=1S/C25H39N7O2S/c1-3-16-31(17-4-2)18-6-5-11-26-19-22-7-9-23(10-8-22)35(33,34)32(20-24-27-12-13-28-24)21-25-29-14-15-30-25/h7-10,12-15,26H,3-6,11,16-21H2,1-2H3,(H,27,28)(H,29,30)