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

Systemtic Name: 4-ethyl-2-[(1-methylpyrazol-4-yl)methylamino]-6-(4-methylsulfonylphenyl)pyridine-3-carbonitrile Openeye Name: 4-ethyl-2-[(1-methylpyrazol-4-yl)methylamino]-6-(4-methylsulfonylphenyl)pyridine-3-carbonitrile CAS Name: 4-ethyl-2-[(1-methyl-4-pyrazolyl)methylamino]-6-(4-methylsulfonylphenyl)-3-pyridinecarbonitrile IUPAC Name: 4-ethyl-2-[(1-methylpyrazol-4-yl)methylamino]-6-(4-methylsulfonylphenyl)pyridine-3-carbonitrile Traditional Name: 4-ethyl-6-(4-mesylphenyl)-2-[(1-methylpyrazol-4-yl)methylamino]nicotinonitrile Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=C1C#N)NCC2=CN(N=C2)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC(=NC(=C1C#N)NCC2=CN(N=C2)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H21N5O2S/c1-4-15-9-19(16-5-7-17(8-6-16)28(3,26)27)24-20(18(15)10-21)22-11-14-12-23-25(2)13-14/h5-9,12-13H,4,11H2,1-3H3,(H,22,24)