methyl 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methyl-amino]-2-propan-2-yl-pentanoate

Systemtic Name: methyl 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methyl-amino]-2-propan-2-yl-pentanoate Openeye Name: methyl 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methyl-amino]-2-isopropyl-pentanoate CAS Name: 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methylamino]-2-propan-2-ylpentanoic acid methyl ester IUPAC Name: methyl 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methylamino]-2-propan-2-ylpentanoate Traditional Name: 2-(3-bromophenyl)-5-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)propyl-methyl-amino]-2-isopropyl-valeric acid methyl ester Formula: C28H38BrN3O2 MolecularWeight: 528.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)CCCN(C)CCCC(C3=CC(=CC=C3)Br)(C(C)C)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CCCN(C)CCCC(C3=CC(=CC=C3)Br)(C(C)C)C(=O)OC

InChI

InChI=1S/C28H38BrN3O2/c1-19(2)28(27(33)34-6,22-10-7-11-23(29)18-22)13-9-15-32(5)14-8-12-26-30-24-16-20(3)21(4)17-25(24)31-26/h7,10-11,16-19H,8-9,12-15H2,1-6H3,(H,30,31)