N-methyl-N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-methanamine

Systemtic Name: N-methyl-N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-methanamine Openeye Name: N-methyl-N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-methanamine CAS Name: N-methyl-N-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]-1-(4-pyrimidinyl)methanamine IUPAC Name: N-methyl-N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-pyrimidin-4-ylmethanamine Traditional Name: methyl-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-(4-pyrimidylmethyl)amine Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CN(C)CC4=NC=NC=C4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CN(C)CC4=NC=NC=C4

InChI

InChI=1S/C23H23N5O/c1-27(16-20-12-13-24-17-25-20)14-19-15-28(2)26-23(19)18-8-10-22(11-9-18)29-21-6-4-3-5-7-21/h3-13,15,17H,14,16H2,1-2H3