4-[2-[5-(4-butylphenyl)pyrimidin-2-yl]ethyl]aniline

Systemtic Name: 4-[2-[5-(4-butylphenyl)pyrimidin-2-yl]ethyl]aniline Openeye Name: 4-[2-[5-(4-butylphenyl)pyrimidin-2-yl]ethyl]aniline CAS Name: 4-[2-[5-(4-butylphenyl)-2-pyrimidinyl]ethyl]aniline IUPAC Name: 4-[2-[5-(4-butylphenyl)pyrimidin-2-yl]ethyl]aniline Traditional Name: [4-[2-[5-(4-butylphenyl)pyrimidin-2-yl]ethyl]phenyl]amine Formula: C22H25N3 MolecularWeight: 331.454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3=CC=C(C=C3)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3=CC=C(C=C3)N

InChI

InChI=1S/C22H25N3/c1-2-3-4-17-5-10-19(11-6-17)20-15-24-22(25-16-20)14-9-18-7-12-21(23)13-8-18/h5-8,10-13,15-16H,2-4,9,14,23H2,1H3