5-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-4-pyridin-4-yl-pyrimidine

Systemtic Name: 5-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-4-pyridin-4-yl-pyrimidine Openeye Name: 5-(p-tolylsulfonyl)-2-(3-pyridyl)-4-(4-pyridyl)pyrimidine CAS Name: 5-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)-4-pyridin-4-ylpyrimidine IUPAC Name: 5-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-4-pyridin-4-ylpyrimidine Traditional Name: 2-(3-pyridyl)-4-(4-pyridyl)-5-tosyl-pyrimidine Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(N=C2C3=CC=NC=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(N=C2C3=CC=NC=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H16N4O2S/c1-15-4-6-18(7-5-15)28(26,27)19-14-24-21(17-3-2-10-23-13-17)25-20(19)16-8-11-22-12-9-16/h2-14H,1H3