4-[3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]pyrazolidin-1-yl]carbonylpyridin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]pyrazolidin-1-yl]carbonylpyridin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[[3-[2-(3,5-dimethylisoxazole-4-carbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]sulfanyl]butanenitrile CAS Name: 4-[[3-[[2-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]-2-pyridinyl]thio]butanenitrile IUPAC Name: 4-[3-[2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)pyrazolidine-1-carbonyl]pyridin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-[2-(3,5-dimethylisoxazole-4-carbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]thio]butyronitrile Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCCN2C(=O)C3=C(N=CC=C3)SCCCC#N

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCCN2C(=O)C3=C(N=CC=C3)SCCCC#N

InChI

InChI=1S/C19H21N5O3S/c1-13-16(14(2)27-22-13)19(26)24-11-6-10-23(24)18(25)15-7-5-9-21-17(15)28-12-4-3-8-20/h5,7,9H,3-4,6,10-12H2,1-2H3