N-(5-tert-butyl-2-chloranyl-phenyl)-2-[4-(4-methoxyphenyl)-3,3-dimethyl-piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(5-tert-butyl-2-chloranyl-phenyl)-2-[4-(4-methoxyphenyl)-3,3-dimethyl-piperazin-1-yl]pyrimidin-4-amine Openeye Name: N-(5-tert-butyl-2-chloro-phenyl)-2-[4-(4-methoxyphenyl)-3,3-dimethyl-piperazin-1-yl]pyrimidin-4-amine CAS Name: N-(5-tert-butyl-2-chlorophenyl)-2-[4-(4-methoxyphenyl)-3,3-dimethyl-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-(5-tert-butyl-2-chlorophenyl)-2-[4-(4-methoxyphenyl)-3,3-dimethylpiperazin-1-yl]pyrimidin-4-amine Traditional Name: (5-tert-butyl-2-chloro-phenyl)-[2-[4-(4-methoxyphenyl)-3,3-dimethyl-piperazino]pyrimidin-4-yl]amine Formula: C27H34ClN5O MolecularWeight: 480.04476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1C2=CC=C(C=C2)OC)C3=NC=CC(=N3)NC4=C(C=CC(=C4)C(C)(C)C)Cl)C

Isomeric SMILES

CC1(CN(CCN1C2=CC=C(C=C2)OC)C3=NC=CC(=N3)NC4=C(C=CC(=C4)C(C)(C)C)Cl)C

InChI

InChI=1S/C27H34ClN5O/c1-26(2,3)19-7-12-22(28)23(17-19)30-24-13-14-29-25(31-24)32-15-16-33(27(4,5)18-32)20-8-10-21(34-6)11-9-20/h7-14,17H,15-16,18H2,1-6H3,(H,29,30,31)