2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(2S)-2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-[(2S)-2-(2-thienyl)pyrrolidino]ethanone Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=NC3=CC=CC=C3O2)C4=CC=CS4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CSC2=NC3=CC=CC=C3O2)C4=CC=CS4

InChI

InChI=1S/C17H16N2O2S2/c20-16(19-9-3-6-13(19)15-8-4-10-22-15)11-23-17-18-12-5-1-2-7-14(12)21-17/h1-2,4-5,7-8,10,13H,3,6,9,11H2/t13-/m0/s1