N4-(diphenylmethyl)-N6-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(diphenylmethyl)-N6-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Openeye Name: N4-benzhydryl-N6-(5-methylisoxazol-3-yl)pyrimidine-4,5,6-triamine CAS Name: N4-(diphenylmethyl)-N6-(5-methyl-3-isoxazolyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-benzhydryl-6-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(benzhydrylamino)pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=C(C(=NC=N2)NC(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC1=CC(=NO1)NC2=C(C(=NC=N2)NC(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C21H20N6O/c1-14-12-17(27-28-14)25-20-18(22)21(24-13-23-20)26-19(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,19H,22H2,1H3,(H2,23,24,25,26,27)