1-[4-[4-[2,4-bis(azanyl)-6-methyl-pyrimidin-5-yl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[2,4-bis(azanyl)-6-methyl-pyrimidin-5-yl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(2,4-diamino-6-methyl-pyrimidin-5-yl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(2,4-diamino-6-methyl-5-pyrimidinyl)-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2,4-diamino-6-methylpyrimidin-5-yl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(2,4-diamino-6-methyl-pyrimidin-5-yl)piperazino]phenyl]ethanone Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C17H22N6O/c1-11-15(16(18)21-17(19)20-11)23-9-7-22(8-10-23)14-5-3-13(4-6-14)12(2)24/h3-6H,7-10H2,1-2H3,(H4,18,19,20,21)