5-[3-(4-tert-butylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-2-chloranyl-pyridine

Systemtic Name: 5-[3-(4-tert-butylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-2-chloranyl-pyridine Openeye Name: 5-[3-(4-tert-butylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-2-chloro-pyridine CAS Name: 5-[3-(4-tert-butylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-2-chloropyridine IUPAC Name: 5-[3-(4-tert-butylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-2-chloropyridine Traditional Name: 5-[5-(4-tert-butylphenyl)-2-pyrazolin-3-yl]-2-chloro-pyridine Formula: C18H20ClN3 MolecularWeight: 313.8245

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(C2)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(C2)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3/c1-18(2,3)14-7-4-12(5-8-14)15-10-16(22-21-15)13-6-9-17(19)20-11-13/h4-9,11,16,22H,10H2,1-3H3