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

Systemtic Name: 4-[3-[2-[(5-methyl-1,2-oxazol-3-yl)carbonyl]pyrazolidin-1-yl]carbonylpyridin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[[3-[2-(5-methylisoxazole-3-carbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]sulfanyl]butanenitrile CAS Name: 4-[[3-[[2-[(5-methyl-3-isoxazolyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]-2-pyridinyl]thio]butanenitrile IUPAC Name: 4-[3-[2-(5-methyl-1,2-oxazole-3-carbonyl)pyrazolidine-1-carbonyl]pyridin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-[2-(5-methylisoxazole-3-carbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]thio]butyronitrile Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O3S/c1-13-12-15(21-26-13)18(25)23-10-5-9-22(23)17(24)14-6-4-8-20-16(14)27-11-3-2-7-19/h4,6,8,12H,2-3,5,9-11H2,1H3