(2R)-2-(4-methyl-1,3-thiazol-2-yl)-4-(2-nitropyridin-3-yl)oxy-3-oxidanylidene-butanenitrile

Systemtic Name: (2R)-2-(4-methyl-1,3-thiazol-2-yl)-4-(2-nitropyridin-3-yl)oxy-3-oxidanylidene-butanenitrile Openeye Name: (2R)-2-(4-methylthiazol-2-yl)-4-[(2-nitro-3-pyridyl)oxy]-3-oxo-butanenitrile CAS Name: (2R)-2-(4-methyl-2-thiazolyl)-4-[(2-nitro-3-pyridinyl)oxy]-3-oxobutanenitrile IUPAC Name: (2R)-2-(4-methyl-1,3-thiazol-2-yl)-4-(2-nitropyridin-3-yl)oxy-3-oxobutanenitrile Traditional Name: (2R)-3-keto-2-(4-methylthiazol-2-yl)-4-[(2-nitro-3-pyridyl)oxy]butyronitrile Formula: C13H10N4O4S MolecularWeight: 318.3079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O4S/c1-8-7-22-13(16-8)9(5-14)10(18)6-21-11-3-2-4-15-12(11)17(19)20/h2-4,7,9H,6H2,1H3/t9-/m1/s1