1-[3-tert-butyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-1,2,4-triazole

Systemtic Name: 1-[3-tert-butyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-1,2,4-triazole Openeye Name: 1-[3-tert-butyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-1,2,4-triazole CAS Name: 1-[3-tert-butyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-1,2,4-triazole IUPAC Name: 1-[3-tert-butyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-4-yl]-1,2,4-triazole Traditional Name: 1-[3-tert-butyl-5-(4-chlorophenyl)-2-pyrazolin-4-yl]-1,2,4-triazole Formula: C15H18ClN5 MolecularWeight: 303.78992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(C1N2C=NC=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=NNC(C1N2C=NC=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H18ClN5/c1-15(2,3)14-13(21-9-17-8-18-21)12(19-20-14)10-4-6-11(16)7-5-10/h4-9,12-13,19H,1-3H3