2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-cyclobutyl-pyrimidine

Systemtic Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-cyclobutyl-pyrimidine Openeye Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-cyclobutyl-pyrimidine CAS Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)thio]propyl]-1-piperazinyl]-6-cyclobutylpyrimidine IUPAC Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-cyclobutylpyrimidine Traditional Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)thio]propyl]piperazino]-6-cyclobutyl-pyrimidine Formula: C26H43N7S MolecularWeight: 485.73152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NN=C(N3C)C(C)(C)C)C4CCC4

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NN=C(N3C)C(C)(C)C)C4CCC4

InChI

InChI=1S/C26H43N7S/c1-25(2,3)22-27-20(19-10-8-11-19)18-21(28-22)33-15-13-32(14-16-33)12-9-17-34-24-30-29-23(31(24)7)26(4,5)6/h18-19H,8-17H2,1-7H3