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

Systemtic Name: 2-[4-[4-(3,4-dimethylphenyl)-3,5-dimethyl-pyrazol-1-yl]phenyl]ethanamine Openeye Name: 2-[4-[4-(3,4-dimethylphenyl)-3,5-dimethyl-pyrazol-1-yl]phenyl]ethanamine CAS Name: 2-[4-[4-(3,4-dimethylphenyl)-3,5-dimethyl-1-pyrazolyl]phenyl]ethanamine IUPAC Name: 2-[4-[4-(3,4-dimethylphenyl)-3,5-dimethylpyrazol-1-yl]phenyl]ethanamine Traditional Name: 2-[4-[4-(3,4-dimethylphenyl)-3,5-dimethyl-pyrazol-1-yl]phenyl]ethylamine Formula: C21H25N3 MolecularWeight: 319.4433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(N(N=C2C)C3=CC=C(C=C3)CCN)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(N(N=C2C)C3=CC=C(C=C3)CCN)C)C

InChI

InChI=1S/C21H25N3/c1-14-5-8-19(13-15(14)2)21-16(3)23-24(17(21)4)20-9-6-18(7-10-20)11-12-22/h5-10,13H,11-12,22H2,1-4H3