N-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine

Systemtic Name: N-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine Openeye Name: N-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine CAS Name: N-[[1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl]-1-(4-pyrimidinyl)ethanamine IUPAC Name: N-[[1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl]-1-pyrimidin-4-ylethanamine Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[1-(4-pyrimidyl)ethyl]amine Formula: C24H25N5 MolecularWeight: 383.4888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CNC(C)C4=NC=NC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CNC(C)C4=NC=NC=C4

InChI

InChI=1S/C24H25N5/c1-17-9-10-18(2)23(13-17)29-15-21(24(28-29)20-7-5-4-6-8-20)14-26-19(3)22-11-12-25-16-27-22/h4-13,15-16,19,26H,14H2,1-3H3