1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-4-carbonitrile

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-4-carbonitrile Openeye Name: 1-(5-methylsulfonyl-2-pyridyl)-5-(3-methyl-4-thiazol-4-yl-phenyl)pyrazole-4-carbonitrile CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-[3-methyl-4-(4-thiazolyl)phenyl]-4-pyrazolecarbonitrile IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-4-carbonitrile Traditional Name: 1-(5-mesyl-2-pyridyl)-5-(3-methyl-4-thiazol-4-yl-phenyl)pyrazole-4-carbonitrile Formula: C20H15N5O2S2 MolecularWeight: 421.4954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C=NN2C3=NC=C(C=C3)S(=O)(=O)C)C#N)C4=CSC=N4

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C=NN2C3=NC=C(C=C3)S(=O)(=O)C)C#N)C4=CSC=N4

InChI

InChI=1S/C20H15N5O2S2/c1-13-7-14(3-5-17(13)18-11-28-12-23-18)20-15(8-21)9-24-25(20)19-6-4-16(10-22-19)29(2,26)27/h3-7,9-12H,1-2H3