3-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-chloro-2-methylsulfonyl-pyrimidin-4-yl)-2-(4-methylthiazol-2-yl)-3-oxo-propanenitrile CAS Name: 3-(5-chloro-2-methylsulfonyl-4-pyrimidinyl)-2-(4-methyl-2-thiazolyl)-3-oxopropanenitrile IUPAC Name: 3-(5-chloro-2-methylsulfonylpyrimidin-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxopropanenitrile Traditional Name: 3-(5-chloro-2-mesyl-pyrimidin-4-yl)-3-keto-2-(4-methylthiazol-2-yl)propionitrile Formula: C12H9ClN4O3S2 MolecularWeight: 356.80786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C

InChI

InChI=1S/C12H9ClN4O3S2/c1-6-5-21-11(16-6)7(3-14)10(18)9-8(13)4-15-12(17-9)22(2,19)20/h4-5,7H,1-2H3