2-[6-chloranyl-1-(3-piperidin-4-ylpropyl)indol-5-yl]-4,5-dimethyl-1H-benzimidazole

Systemtic Name: 2-[6-chloranyl-1-(3-piperidin-4-ylpropyl)indol-5-yl]-4,5-dimethyl-1H-benzimidazole Openeye Name: 2-[6-chloro-1-[3-(4-piperidyl)propyl]indol-5-yl]-4,5-dimethyl-1H-benzimidazole CAS Name: 2-[6-chloro-1-[3-(4-piperidinyl)propyl]-5-indolyl]-4,5-dimethyl-1H-benzimidazole IUPAC Name: 2-[6-chloro-1-(3-piperidin-4-ylpropyl)indol-5-yl]-4,5-dimethyl-1H-benzimidazole Traditional Name: 2-[6-chloro-1-[3-(4-piperidyl)propyl]indol-5-yl]-4,5-dimethyl-1H-benzimidazole Formula: C25H29ClN4 MolecularWeight: 420.97756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)NC(=N2)C3=C(C=C4C(=C3)C=CN4CCCC5CCNCC5)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)NC(=N2)C3=C(C=C4C(=C3)C=CN4CCCC5CCNCC5)Cl)C

InChI

InChI=1S/C25H29ClN4/c1-16-5-6-22-24(17(16)2)29-25(28-22)20-14-19-9-13-30(23(19)15-21(20)26)12-3-4-18-7-10-27-11-8-18/h5-6,9,13-15,18,27H,3-4,7-8,10-12H2,1-2H3,(H,28,29)