4-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-2-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-2-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 4-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidine CAS Name: 4-[5-(1-benzothiophen-2-yl)-3-pyridinyl]-2-methyl-6-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-2-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 4-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-6-[4-(2-pyridyl)piperazino]pyrimidine Formula: C27H24N6S MolecularWeight: 464.58466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C3=CC=CC=N3)C4=CC(=CN=C4)C5=CC6=CC=CC=C6S5

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C3=CC=CC=N3)C4=CC(=CN=C4)C5=CC6=CC=CC=C6S5

InChI

InChI=1S/C27H24N6S/c1-19-30-23(16-27(31-19)33-12-10-32(11-13-33)26-8-4-5-9-29-26)21-14-22(18-28-17-21)25-15-20-6-2-3-7-24(20)34-25/h2-9,14-18H,10-13H2,1H3