N,N-diethyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-diethyl-2-[(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N,N-diethyl-2-[[(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N,N-diethyl-2-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]sulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[[(1R)-2-keto-1-methyl-2-pyrrolidino-ethyl]thio]-1,3-benzoxazole-5-sulfonamide Formula: C18H25N3O4S2 MolecularWeight: 411.5388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SC(C)C(=O)N3CCCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)S[C@H](C)C(=O)N3CCCC3

InChI

InChI=1S/C18H25N3O4S2/c1-4-21(5-2)27(23,24)14-8-9-16-15(12-14)19-18(25-16)26-13(3)17(22)20-10-6-7-11-20/h8-9,12-13H,4-7,10-11H2,1-3H3/t13-/m1/s1