[2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidin-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidin-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidin-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(1,3-benzoxazol-2-ylamino)-4-methyl-5-pyrimidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(1,3-benzoxazol-2-ylamino)-4-methylpyrimidin-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(1,3-benzoxazol-2-ylamino)-4-methyl-pyrimidin-5-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H20N8O2 MolecularWeight: 416.4359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)NC4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)NC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H20N8O2/c1-14-15(18(30)28-9-11-29(12-10-28)20-22-7-4-8-23-20)13-24-19(25-14)27-21-26-16-5-2-3-6-17(16)31-21/h2-8,13H,9-12H2,1H3,(H,24,25,26,27)