5-chloranyl-N2-(2,5-dimethyl-4-piperidin-3-yl-phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Systemtic Name: 5-chloranyl-N2-(2,5-dimethyl-4-piperidin-3-yl-phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[2,5-dimethyl-4-(3-piperidyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[2,5-dimethyl-4-(3-piperidinyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-(2,5-dimethyl-4-piperidin-3-ylphenyl)-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[2,5-dimethyl-4-(3-piperidyl)anilino]pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C21H26ClN7 MolecularWeight: 411.93104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2CCCNC2)C)NC3=NC=C(C(=N3)NC4=NNC(=C4)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C2CCCNC2)C)NC3=NC=C(C(=N3)NC4=NNC(=C4)C)Cl

InChI

InChI=1S/C21H26ClN7/c1-12-8-18(13(2)7-16(12)15-5-4-6-23-10-15)25-21-24-11-17(22)20(27-21)26-19-9-14(3)28-29-19/h7-9,11,15,23H,4-6,10H2,1-3H3,(H3,24,25,26,27,28,29)