2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]-1-piperidyl]pyrimidine CAS Name: 2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[5-methyl-4-(2-propylphenyl)-1,2,4-triazol-3-yl]piperidino]pyrimidine Formula: C21H26N6 MolecularWeight: 362.47134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1N2C(=NN=C2C3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CCCC1=CC=CC=C1N2C(=NN=C2C3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C21H26N6/c1-3-7-17-8-4-5-9-19(17)27-16(2)24-25-20(27)18-10-14-26(15-11-18)21-22-12-6-13-23-21/h4-6,8-9,12-13,18H,3,7,10-11,14-15H2,1-2H3