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

Systemtic Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine Openeye Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N4-(5-methylisoxazol-3-yl)pyrimidine-4,5-diamine CAS Name: 6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N4-(5-methyl-3-isoxazolyl)pyrimidine-4,5-diamine IUPAC Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(2,3-dimethylphenyl)piperazino]pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=NOC(=C4)C)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=NOC(=C4)C)N)C

InChI

InChI=1S/C20H25N7O/c1-13-5-4-6-16(15(13)3)26-7-9-27(10-8-26)20-18(21)19(22-12-23-20)24-17-11-14(2)28-25-17/h4-6,11-12H,7-10,21H2,1-3H3,(H,22,23,24,25)