5-(4-methoxyphenyl)-N-[4-(2-piperazin-1-ylethyl)phenyl]pyrimidin-2-amine

Systemtic Name: 5-(4-methoxyphenyl)-N-[4-(2-piperazin-1-ylethyl)phenyl]pyrimidin-2-amine Openeye Name: 5-(4-methoxyphenyl)-N-[4-(2-piperazin-1-ylethyl)phenyl]pyrimidin-2-amine CAS Name: 5-(4-methoxyphenyl)-N-[4-[2-(1-piperazinyl)ethyl]phenyl]-2-pyrimidinamine IUPAC Name: 5-(4-methoxyphenyl)-N-[4-(2-piperazin-1-ylethyl)phenyl]pyrimidin-2-amine Traditional Name: [5-(4-methoxyphenyl)pyrimidin-2-yl]-[4-(2-piperazinoethyl)phenyl]amine Formula: C23H27N5O MolecularWeight: 389.49338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)CCN4CCNCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CC=C(C=C3)CCN4CCNCC4

InChI

InChI=1S/C23H27N5O/c1-29-22-8-4-19(5-9-22)20-16-25-23(26-17-20)27-21-6-2-18(3-7-21)10-13-28-14-11-24-12-15-28/h2-9,16-17,24H,10-15H2,1H3,(H,25,26,27)