4-ethyl-6-(4-methylsulfonylphenyl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile

Systemtic Name: 4-ethyl-6-(4-methylsulfonylphenyl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile Openeye Name: 4-ethyl-6-(4-methylsulfonylphenyl)-2-[(4-methylthiazol-2-yl)methylamino]pyridine-3-carbonitrile CAS Name: 4-ethyl-6-(4-methylsulfonylphenyl)-2-[(4-methyl-2-thiazolyl)methylamino]-3-pyridinecarbonitrile IUPAC Name: 4-ethyl-6-(4-methylsulfonylphenyl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile Traditional Name: 4-ethyl-6-(4-mesylphenyl)-2-[(4-methylthiazol-2-yl)methylamino]nicotinonitrile Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=C1C#N)NCC2=NC(=CS2)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC(=NC(=C1C#N)NCC2=NC(=CS2)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H20N4O2S2/c1-4-14-9-18(15-5-7-16(8-6-15)28(3,25)26)24-20(17(14)10-21)22-11-19-23-13(2)12-27-19/h5-9,12H,4,11H2,1-3H3,(H,22,24)