N4-(5-methyl-1,2-oxazol-3-yl)-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-4,5-diamine

Systemtic Name: N4-(5-methyl-1,2-oxazol-3-yl)-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-4,5-diamine Openeye Name: 6-(4-benzyl-1-piperidyl)-N4-(5-methylisoxazol-3-yl)pyrimidine-4,5-diamine CAS Name: N4-(5-methyl-3-isoxazolyl)-6-[4-(phenylmethyl)-1-piperidinyl]pyrimidine-4,5-diamine IUPAC Name: 6-(4-benzylpiperidin-1-yl)-4-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-benzylpiperidino)pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C20H24N6O MolecularWeight: 364.44416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=NC=NC(=C2N)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC2=NC=NC(=C2N)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N6O/c1-14-11-17(25-27-14)24-19-18(21)20(23-13-22-19)26-9-7-16(8-10-26)12-15-5-3-2-4-6-15/h2-6,11,13,16H,7-10,12,21H2,1H3,(H,22,23,24,25)