2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-cyclopropyl-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-cyclopropyl-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-cyclopropyl-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-cyclopropylpyrimidine 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-cyclopropylpyrimidine Traditional Name: 2-tert-butyl-4-[4-[3-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)thio]propyl]piperazino]-6-cyclopropyl-pyrimidine Formula: C25H41N7S MolecularWeight: 471.70494

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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)C4CC4

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NN=C(N3C)C(C)(C)C)C4CC4

InChI

InChI=1S/C25H41N7S/c1-24(2,3)21-26-19(18-9-10-18)17-20(27-21)32-14-12-31(13-15-32)11-8-16-33-23-29-28-22(30(23)7)25(4,5)6/h17-18H,8-16H2,1-7H3