1-[5-tert-butyl-3-(2-pyrrolidin-1-ylethyl)-1-benzofuran-7-yl]-3-[4-(pyridin-4-ylmethoxy)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-3-(2-pyrrolidin-1-ylethyl)-1-benzofuran-7-yl]-3-[4-(pyridin-4-ylmethoxy)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-3-(2-pyrrolidin-1-ylethyl)benzofuran-7-yl]-3-[4-(4-pyridylmethoxy)-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-3-[2-(1-pyrrolidinyl)ethyl]-7-benzofuranyl]-3-[4-(pyridin-4-ylmethoxy)-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-3-(2-pyrrolidin-1-ylethyl)-1-benzofuran-7-yl]-3-[4-(pyridin-4-ylmethoxy)naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-3-(2-pyrrolidinoethyl)benzofuran-7-yl]-3-[4-(4-pyridylmethoxy)-1-naphthyl]urea Formula: C35H38N4O3 MolecularWeight: 562.70122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C(=CO2)CCN3CCCC3)NC(=O)NC4=CC=C(C5=CC=CC=C54)OCC6=CC=NC=C6

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C(=CO2)CCN3CCCC3)NC(=O)NC4=CC=C(C5=CC=CC=C54)OCC6=CC=NC=C6

InChI

InChI=1S/C35H38N4O3/c1-35(2,3)26-20-29-25(14-19-39-17-6-7-18-39)23-42-33(29)31(21-26)38-34(40)37-30-10-11-32(28-9-5-4-8-27(28)30)41-22-24-12-15-36-16-13-24/h4-5,8-13,15-16,20-21,23H,6-7,14,17-19,22H2,1-3H3,(H2,37,38,40)