2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(5-pyrrolidin-1-ylpyridin-2-yl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(5-pyrrolidin-1-ylpyridin-2-yl)ethanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(5-pyrrolidin-1-yl-2-pyridyl)acetamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[5-(1-pyrrolidinyl)-2-pyridinyl]acetamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(5-pyrrolidin-1-ylpyridin-2-yl)acetamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(5-pyrrolidino-2-pyridyl)acetamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC2=NC=C(C=C2)N3CCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC2=NC=C(C=C2)N3CCCC3

InChI

InChI=1S/C17H22N4O2S/c1-12-15(13(2)23-20-12)10-24-11-17(22)19-16-6-5-14(9-18-16)21-7-3-4-8-21/h5-6,9H,3-4,7-8,10-11H2,1-2H3,(H,18,19,22)