3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyl-oxiran-2-yl]cyclopentan-1-one

Systemtic Name: 3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyl-oxiran-2-yl]cyclopentan-1-one Openeye Name: 3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyl-oxiran-2-yl]cyclopentanone CAS Name: 3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyl-2-oxiranyl]-1-cyclopentanone IUPAC Name: 3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyloxiran-2-yl]cyclopentan-1-one Traditional Name: 3-[2-(5,7a-dihydro-1,3-benzothiazol-2-yl)-3,3-dimethyl-oxiran-2-yl]cyclopentanone Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(O1)(C2CCC(=O)C2)C3=NC4=CCC=CC4S3)C

Isomeric SMILES

CC1(C(O1)(C2CCC(=O)C2)C3=NC4=CCC=CC4S3)C

InChI

InChI=1S/C16H19NO2S/c1-15(2)16(19-15,10-7-8-11(18)9-10)14-17-12-5-3-4-6-13(12)20-14/h4-6,10,13H,3,7-9H2,1-2H3