4-(2,3-dihydro-1-benzofuran-5-ylmethoxy)-2-(2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-1-yl)pyrimidine-5-carboxamide

Systemtic Name: 4-(2,3-dihydro-1-benzofuran-5-ylmethoxy)-2-(2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-1-yl)pyrimidine-5-carboxamide Openeye Name: 4-(2,3-dihydrobenzofuran-5-ylmethoxy)-2-indolin-1-yl-N-(2-oxoazepan-1-yl)pyrimidine-5-carboxamide CAS Name: 4-(2,3-dihydrobenzofuran-5-ylmethoxy)-2-(2,3-dihydroindol-1-yl)-N-(2-oxo-1-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(2,3-dihydro-1-benzofuran-5-ylmethoxy)-2-(2,3-dihydroindol-1-yl)-N-(2-oxoazepan-1-yl)pyrimidine-5-carboxamide Traditional Name: 4-(coumaran-5-ylmethoxy)-2-indolin-1-yl-N-(2-ketoazepan-1-yl)pyrimidine-5-carboxamide Formula: C28H29N5O4 MolecularWeight: 499.56096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)NC(=O)C2=CN=C(N=C2OCC3=CC4=C(C=C3)OCC4)N5CCC6=CC=CC=C65

Isomeric SMILES

C1CCC(=O)N(CC1)NC(=O)C2=CN=C(N=C2OCC3=CC4=C(C=C3)OCC4)N5CCC6=CC=CC=C65

InChI

InChI=1S/C28H29N5O4/c34-25-8-2-1-5-13-33(25)31-26(35)22-17-29-28(32-14-11-20-6-3-4-7-23(20)32)30-27(22)37-18-19-9-10-24-21(16-19)12-15-36-24/h3-4,6-7,9-10,16-17H,1-2,5,8,11-15,18H2,(H,31,35)