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

Systemtic Name: 2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-1,3-benzoxazole Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H17N3O3S2/c21-25(22,20-9-3-4-10-20)13-7-8-17(18-11-13)24-12-16-19-14-5-1-2-6-15(14)23-16/h1-2,5-8,11H,3-4,9-10,12H2