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

Systemtic Name: 2-(2,3-dihydroindol-1-yl)-N-(phenylmethyl)-4-(pyridin-4-ylmethylamino)pyrimidine-5-carboxamide Openeye Name: N-benzyl-2-indolin-1-yl-4-(4-pyridylmethylamino)pyrimidine-5-carboxamide CAS Name: 2-(2,3-dihydroindol-1-yl)-N-(phenylmethyl)-4-(pyridin-4-ylmethylamino)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-(2,3-dihydroindol-1-yl)-4-(pyridin-4-ylmethylamino)pyrimidine-5-carboxamide Traditional Name: N-benzyl-2-indolin-1-yl-4-(4-pyridylmethylamino)pyrimidine-5-carboxamide Formula: C26H24N6O MolecularWeight: 436.50836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC=NC=C4)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC=NC=C4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C26H24N6O/c33-25(29-17-19-6-2-1-3-7-19)22-18-30-26(32-15-12-21-8-4-5-9-23(21)32)31-24(22)28-16-20-10-13-27-14-11-20/h1-11,13-14,18H,12,15-17H2,(H,29,33)(H,28,30,31)