4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-[3-(3-piperazin-1-ylpropoxy)phenyl]pyrimidin-2-amine

Systemtic Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-[3-(3-piperazin-1-ylpropoxy)phenyl]pyrimidin-2-amine Openeye Name: 4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)-N-[3-(3-piperazin-1-ylpropoxy)phenyl]pyrimidin-2-amine CAS Name: 4-(3-cyclohexyl-5-methyl-4-isoxazolyl)-N-[3-[3-(1-piperazinyl)propoxy]phenyl]-2-pyrimidinamine IUPAC Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-[3-(3-piperazin-1-ylpropoxy)phenyl]pyrimidin-2-amine Traditional Name: [4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)pyrimidin-2-yl]-[3-(3-piperazinopropoxy)phenyl]amine Formula: C27H36N6O2 MolecularWeight: 476.61374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCCCN5CCNCC5

Isomeric SMILES

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCCCN5CCNCC5

InChI

InChI=1S/C27H36N6O2/c1-20-25(26(32-35-20)21-7-3-2-4-8-21)24-11-12-29-27(31-24)30-22-9-5-10-23(19-22)34-18-6-15-33-16-13-28-14-17-33/h5,9-12,19,21,28H,2-4,6-8,13-18H2,1H3,(H,29,30,31)