6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide

Systemtic Name: 6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide Openeye Name: 6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide CAS Name: 6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide IUPAC Name: 6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide Traditional Name: 6-(1,3-benzothiazol-2-ylmethyl)-N-(3-fluorophenyl)-6-azaspiro[2.5]octane-2-carboxamide Formula: C22H22FN3OS MolecularWeight: 395.492983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC2C(=O)NC3=CC(=CC=C3)F)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCC12CC2C(=O)NC3=CC(=CC=C3)F)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H22FN3OS/c23-15-4-3-5-16(12-15)24-21(27)17-13-22(17)8-10-26(11-9-22)14-20-25-18-6-1-2-7-19(18)28-20/h1-7,12,17H,8-11,13-14H2,(H,24,27)