3-methyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3-methyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 3-methyl-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]isoxazole CAS Name: 3-methyl-5-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]isoxazole IUPAC Name: 3-methyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 3-methyl-5-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]isoxazole Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=NOC(=C1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C14H17N3O3S2/c1-11-8-12(20-16-11)10-21-14-5-4-13(9-15-14)22(18,19)17-6-2-3-7-17/h4-5,8-9H,2-3,6-7,10H2,1H3