2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]-N-(phenylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]-N-(phenylmethyl)pyrimidine-5-carboxamide Openeye Name: N-benzyl-4-[(3-fluorophenyl)methylamino]-2-indolin-1-yl-pyrimidine-5-carboxamide CAS Name: 2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]-N-(phenylmethyl)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]pyrimidine-5-carboxamide Traditional Name: N-benzyl-4-[(3-fluorobenzyl)amino]-2-indolin-1-yl-pyrimidine-5-carboxamide Formula: C27H24FN5O MolecularWeight: 453.510763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24FN5O/c28-22-11-6-9-20(15-22)17-29-25-23(26(34)30-16-19-7-2-1-3-8-19)18-31-27(32-25)33-14-13-21-10-4-5-12-24(21)33/h1-12,15,18H,13-14,16-17H2,(H,30,34)(H,29,31,32)