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

Systemtic Name: 2-tert-butyl-4-[4-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-propyl-pyrimidine Openeye Name: 2-tert-butyl-4-[4-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-propyl-pyrimidine CAS Name: 2-tert-butyl-4-[4-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propyl]-1-piperazinyl]-6-propylpyrimidine IUPAC Name: 2-tert-butyl-4-[4-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]-6-propylpyrimidine Traditional Name: 2-tert-butyl-4-[4-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propyl]piperazino]-6-propyl-pyrimidine Formula: C21H35N7S MolecularWeight: 417.6145

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCSC3=NN=CN3C

Isomeric SMILES

CCCC1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCSC3=NN=CN3C

InChI

InChI=1S/C21H35N7S/c1-6-8-17-15-18(24-19(23-17)21(2,3)4)28-12-10-27(11-13-28)9-7-14-29-20-25-22-16-26(20)5/h15-16H,6-14H2,1-5H3