2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]piperazin-1-yl]pyrimidine

Systemtic Name: 2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]piperazin-1-yl]pyrimidine Openeye Name: 2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]piperazin-1-yl]pyrimidine CAS Name: 2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]-1-piperazinyl]pyrimidine IUPAC Name: 2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]piperazin-1-yl]pyrimidine Traditional Name: 2,4-ditert-butyl-6-[4-[4-(4-methyl-5-phenyl-1,2,4-triazol-3-yl)butyl]piperazino]pyrimidine Formula: C29H43N7 MolecularWeight: 489.69862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCCC3=NN=C(N3C)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCCC3=NN=C(N3C)C4=CC=CC=C4

InChI

InChI=1S/C29H43N7/c1-28(2,3)23-21-25(31-27(30-23)29(4,5)6)36-19-17-35(18-20-36)16-12-11-15-24-32-33-26(34(24)7)22-13-9-8-10-14-22/h8-10,13-14,21H,11-12,15-20H2,1-7H3