(2R)-2-phenyl-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: (2R)-2-phenyl-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: (2R)-2-phenyl-2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: (2R)-2-phenyl-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: (2R)-2-phenyl-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: (2R)-2-phenyl-2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]-1-pyrrolidino-ethanone Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SC(C4=CC=CC=C4)C(=O)N5CCCC5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)S[C@H](C4=CC=CC=C4)C(=O)N5CCCC5

InChI

InChI=1S/C24H27N3O4S2/c28-23(26-13-7-8-14-26)22(18-9-3-1-4-10-18)32-24-25-20-17-19(11-12-21(20)31-24)33(29,30)27-15-5-2-6-16-27/h1,3-4,9-12,17,22H,2,5-8,13-16H2/t22-/m1/s1