3-azanyl-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide

Systemtic Name: 3-azanyl-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Openeye Name: 3-amino-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide CAS Name: 3-amino-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methylbenzamide IUPAC Name: 3-amino-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methylbenzamide Traditional Name: 3-amino-N-[4-(dipropylamino)butyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Formula: C26H39N7O MolecularWeight: 465.63416

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCCNC(=O)C1=CC(=C(C(=C1C)N)CC2=NC=CN2)CC3=NC=CN3

Isomeric SMILES

CCCN(CCC)CCCCNC(=O)C1=CC(=C(C(=C1C)N)CC2=NC=CN2)CC3=NC=CN3

InChI

InChI=1S/C26H39N7O/c1-4-13-33(14-5-2)15-7-6-8-32-26(34)21-16-20(17-23-28-9-10-29-23)22(25(27)19(21)3)18-24-30-11-12-31-24/h9-12,16H,4-8,13-15,17-18,27H2,1-3H3,(H,28,29)(H,30,31)(H,32,34)