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

Systemtic Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-[3-(4-piperazin-1-ylbutoxy)phenyl]pyrimidin-2-amine Openeye Name: 4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)-N-[3-(4-piperazin-1-ylbutoxy)phenyl]pyrimidin-2-amine CAS Name: 4-(3-cyclohexyl-5-methyl-4-isoxazolyl)-N-[3-[4-(1-piperazinyl)butoxy]phenyl]-2-pyrimidinamine IUPAC Name: 4-(3-cyclohexyl-5-methyl-1,2-oxazol-4-yl)-N-[3-(4-piperazin-1-ylbutoxy)phenyl]pyrimidin-2-amine Traditional Name: [4-(3-cyclohexyl-5-methyl-isoxazol-4-yl)pyrimidin-2-yl]-[3-(4-piperazinobutoxy)phenyl]amine Formula: C28H38N6O2 MolecularWeight: 490.64032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCCCCN5CCNCC5

Isomeric SMILES

CC1=C(C(=NO1)C2CCCCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCCCCN5CCNCC5

InChI

InChI=1S/C28H38N6O2/c1-21-26(27(33-36-21)22-8-3-2-4-9-22)25-12-13-30-28(32-25)31-23-10-7-11-24(20-23)35-19-6-5-16-34-17-14-29-15-18-34/h7,10-13,20,22,29H,2-6,8-9,14-19H2,1H3,(H,30,31,32)