1-[3-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline

Systemtic Name: 1-[3-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline Openeye Name: 1-[3-(4-isopropylphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline CAS Name: 1-[3-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline IUPAC Name: 1-[3-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-5-yl]isoquinoline Traditional Name: 1-(3-p-cumenyl-1H-1,2,4-triazol-5-yl)isoquinoline Formula: C20H18N4 MolecularWeight: 314.38372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NNC(=N2)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NNC(=N2)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C20H18N4/c1-13(2)14-7-9-16(10-8-14)19-22-20(24-23-19)18-17-6-4-3-5-15(17)11-12-21-18/h3-13H,1-2H3,(H,22,23,24)