4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrimidin-2-amine

Systemtic Name: 4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrimidin-2-amine Openeye Name: 4-[5-(3-benzyloxyphenyl)-1H-pyrazol-4-yl]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrimidin-2-amine CAS Name: 4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]-N-[4-(1-pyrrolidinylmethyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrimidin-2-amine Traditional Name: [4-[5-(3-benzoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-[4-(pyrrolidinomethyl)phenyl]amine Formula: C31H30N6O MolecularWeight: 502.6095

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC(=CC=C5)OCC6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC(=CC=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C31H30N6O/c1-2-7-24(8-3-1)22-38-27-10-6-9-25(19-27)30-28(20-33-36-30)29-15-16-32-31(35-29)34-26-13-11-23(12-14-26)21-37-17-4-5-18-37/h1-3,6-16,19-20H,4-5,17-18,21-22H2,(H,33,36)(H,32,34,35)