N-[[1-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide

Systemtic Name: N-[[1-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide Openeye Name: N-[[1-[3-(2-isopropyl-5-methyl-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide CAS Name: N-[[1-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]-2-benzimidazolyl]methyl]-4-pyridinecarboxamide IUPAC Name: N-[[1-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide Traditional Name: N-[[1-[3-(2-isopropyl-5-methyl-phenoxy)propyl]benzimidazol-2-yl]methyl]isonicotinamide Formula: C27H30N4O2 MolecularWeight: 442.5527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCCN2C3=CC=CC=C3N=C2CNC(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCCN2C3=CC=CC=C3N=C2CNC(=O)C4=CC=NC=C4

InChI

InChI=1S/C27H30N4O2/c1-19(2)22-10-9-20(3)17-25(22)33-16-6-15-31-24-8-5-4-7-23(24)30-26(31)18-29-27(32)21-11-13-28-14-12-21/h4-5,7-14,17,19H,6,15-16,18H2,1-3H3,(H,29,32)