N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorophenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorophenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-fluorobenzyl)amino]-4-methyl-pyrimidine-5-carboxamide Formula: C21H19FN4O3 MolecularWeight: 394.398963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCCO3)NCC4=CC=CC=C4F

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCCO3)NCC4=CC=CC=C4F

InChI

InChI=1S/C21H19FN4O3/c1-13-16(12-24-21(25-13)23-11-14-4-2-3-5-17(14)22)20(27)26-15-6-7-18-19(10-15)29-9-8-28-18/h2-7,10,12H,8-9,11H2,1H3,(H,26,27)(H,23,24,25)