N-(3-methyl-1,2-oxazol-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(3-methyl-1,2-oxazol-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(3-methylisoxazol-5-yl)-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propionamide Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=NOC(=C1)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H20N4O4S2/c1-11-9-14(24-19-11)18-16(21)12(2)25-15-6-5-13(10-17-15)26(22,23)20-7-3-4-8-20/h5-6,9-10,12H,3-4,7-8H2,1-2H3,(H,18,21)