4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-(2-phenylsulfanylpyridin-4-yl)-1,3-thiazole

Systemtic Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-(2-phenylsulfanylpyridin-4-yl)-1,3-thiazole Openeye Name: 2-(4-methylsulfonylphenyl)-4-(m-tolyl)-5-(2-phenylsulfanyl-4-pyridyl)thiazole CAS Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-[2-(phenylthio)-4-pyridinyl]thiazole IUPAC Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-(2-phenylsulfanylpyridin-4-yl)-1,3-thiazole Traditional Name: 2-(4-mesylphenyl)-4-(m-tolyl)-5-[2-(phenylthio)-4-pyridyl]thiazole Formula: C28H22N2O2S3 MolecularWeight: 514.68148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(SC(=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC(=NC=C4)SC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(SC(=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC(=NC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C28H22N2O2S3/c1-19-7-6-8-21(17-19)26-27(22-15-16-29-25(18-22)33-23-9-4-3-5-10-23)34-28(30-26)20-11-13-24(14-12-20)35(2,31)32/h3-18H,1-2H3