3-[7-(4-methylphenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol

Systemtic Name: 3-[7-(4-methylphenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol Openeye Name: 3-[5-phenyl-7-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol CAS Name: 3-[7-(4-methylphenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1-propanol IUPAC Name: 3-[7-(4-methylphenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol Traditional Name: 3-[5-phenyl-7-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)CCCO)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)CCCO)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O/c1-15-9-11-17(12-10-15)19-14-18(16-6-3-2-4-7-16)22-21-23-20(8-5-13-26)24-25(19)21/h2-4,6-7,9-12,14,19,26H,5,8,13H2,1H3,(H,22,23,24)