N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-(3-propan-2-yloxypropyl)pyrrol-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-(3-propan-2-yloxypropyl)pyrrol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)-1-(3-isopropoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-4-fluoro-benzamide CAS Name: N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-(3-propan-2-yloxypropyl)-2-pyrrolyl]-4-fluorobenzamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-(3-propan-2-yloxypropyl)pyrrol-2-yl]-4-fluorobenzamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)-1-(3-isopropoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-4-fluoro-benzamide Formula: C26H29FN4O2 MolecularWeight: 448.532463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=C(C=C4)F)CCCOC(C)C)C

Isomeric SMILES

CC1=C(N(C(=C1C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=C(C=C4)F)CCCOC(C)C)C

InChI

InChI=1S/C26H29FN4O2/c1-16(2)33-15-7-14-31-18(4)17(3)23(24-28-21-8-5-6-9-22(21)29-24)25(31)30-26(32)19-10-12-20(27)13-11-19/h5-6,8-13,16H,7,14-15H2,1-4H3,(H,28,29)(H,30,32)