3-butyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-butyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-butyl-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-butyl-5-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-butyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-butyl-5-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-1,2,4-oxadiazole Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCCC1=NOC(=N1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H22N4O3S2/c1-2-3-6-14-18-15(23-19-14)12-24-16-8-7-13(11-17-16)25(21,22)20-9-4-5-10-20/h7-8,11H,2-6,9-10,12H2,1H3