2-tert-butyl-4-cyclobutyl-6-[4-(3-pyrimidin-2-ylsulfanylpropyl)piperazin-1-yl]pyrimidine

Systemtic Name: 2-tert-butyl-4-cyclobutyl-6-[4-(3-pyrimidin-2-ylsulfanylpropyl)piperazin-1-yl]pyrimidine Openeye Name: 2-tert-butyl-4-cyclobutyl-6-[4-(3-pyrimidin-2-ylsulfanylpropyl)piperazin-1-yl]pyrimidine CAS Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-(2-pyrimidinylthio)propyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-tert-butyl-4-cyclobutyl-6-[4-(3-pyrimidin-2-ylsulfanylpropyl)piperazin-1-yl]pyrimidine Traditional Name: 2-tert-butyl-4-cyclobutyl-6-[4-[3-(2-pyrimidylthio)propyl]piperazino]pyrimidine Formula: C23H34N6S MolecularWeight: 426.62126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NC=CC=N3)C4CCC4

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCSC3=NC=CC=N3)C4CCC4

InChI

InChI=1S/C23H34N6S/c1-23(2,3)21-26-19(18-7-4-8-18)17-20(27-21)29-14-12-28(13-15-29)11-6-16-30-22-24-9-5-10-25-22/h5,9-10,17-18H,4,6-8,11-16H2,1-3H3