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

Systemtic Name: N-(cyanomethyl)-2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]pyrimidine-5-carboxamide Openeye Name: N-(cyanomethyl)-4-[(4-fluorophenyl)methylamino]-2-indolin-1-yl-pyrimidine-5-carboxamide CAS Name: N-(cyanomethyl)-2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]-5-pyrimidinecarboxamide IUPAC Name: N-(cyanomethyl)-2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]pyrimidine-5-carboxamide Traditional Name: N-(cyanomethyl)-4-[(4-fluorobenzyl)amino]-2-indolin-1-yl-pyrimidine-5-carboxamide Formula: C22H19FN6O MolecularWeight: 402.424263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC=C(C=C4)F)C(=O)NCC#N

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=NC=C(C(=N3)NCC4=CC=C(C=C4)F)C(=O)NCC#N

InChI

InChI=1S/C22H19FN6O/c23-17-7-5-15(6-8-17)13-26-20-18(21(30)25-11-10-24)14-27-22(28-20)29-12-9-16-3-1-2-4-19(16)29/h1-8,14H,9,11-13H2,(H,25,30)(H,26,27,28)