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

Systemtic Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-(2-pyrrolidin-1-ylpyridin-4-yl)-1,3-thiazole Openeye Name: 2-(4-methylsulfonylphenyl)-4-(m-tolyl)-5-(2-pyrrolidin-1-yl-4-pyridyl)thiazole CAS Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-[2-(1-pyrrolidinyl)-4-pyridinyl]thiazole IUPAC Name: 4-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-5-(2-pyrrolidin-1-ylpyridin-4-yl)-1,3-thiazole Traditional Name: 2-(4-mesylphenyl)-4-(m-tolyl)-5-(2-pyrrolidino-4-pyridyl)thiazole Formula: C26H25N3O2S2 MolecularWeight: 475.6256

Click to see the large picture

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)N5CCCC5

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(SC(=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC(=NC=C4)N5CCCC5

InChI

InChI=1S/C26H25N3O2S2/c1-18-6-5-7-20(16-18)24-25(21-12-13-27-23(17-21)29-14-3-4-15-29)32-26(28-24)19-8-10-22(11-9-19)33(2,30)31/h5-13,16-17H,3-4,14-15H2,1-2H3