4-(4-tert-butylphenyl)sulfanyl-2-phenyl-5-(phenylsulfonyl)pyrimidine

Systemtic Name: 4-(4-tert-butylphenyl)sulfanyl-2-phenyl-5-(phenylsulfonyl)pyrimidine Openeye Name: 5-(benzenesulfonyl)-4-(4-tert-butylphenyl)sulfanyl-2-phenyl-pyrimidine CAS Name: 5-(benzenesulfonyl)-4-[(4-tert-butylphenyl)thio]-2-phenylpyrimidine IUPAC Name: 5-(benzenesulfonyl)-4-(4-tert-butylphenyl)sulfanyl-2-phenylpyrimidine Traditional Name: 5-besyl-4-[(4-tert-butylphenyl)thio]-2-phenyl-pyrimidine Formula: C26H24N2O2S2 MolecularWeight: 460.61096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=NC(=NC=C2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=NC(=NC=C2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O2S2/c1-26(2,3)20-14-16-21(17-15-20)31-25-23(32(29,30)22-12-8-5-9-13-22)18-27-24(28-25)19-10-6-4-7-11-19/h4-18H,1-3H3