4-(1,3-benzodioxol-5-ylmethylamino)-2-(2,3-dihydroindol-1-yl)-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2,3-dihydroindol-1-yl)-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-indolin-1-yl-N-(2-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2,3-dihydroindol-1-yl)-N-(2-pyridinylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2,3-dihydroindol-1-yl)-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-indolin-1-yl-4-(piperonylamino)-N-(2-pyridylmethyl)pyrimidine-5-carboxamide Formula: C27H24N6O3 MolecularWeight: 480.51786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC5=C(C=C4)OCO5)C(=O)NCC6=CC=CC=N6

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC5=C(C=C4)OCO5)C(=O)NCC6=CC=CC=N6

InChI

InChI=1S/C27H24N6O3/c34-26(30-15-20-6-3-4-11-28-20)21-16-31-27(33-12-10-19-5-1-2-7-22(19)33)32-25(21)29-14-18-8-9-23-24(13-18)36-17-35-23/h1-9,11,13,16H,10,12,14-15,17H2,(H,30,34)(H,29,31,32)