1-[4-(5-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(5-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]-2-(2-quinolinylthio)ethanone IUPAC Name: 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-[4-(5-fluoroindoxazen-3-yl)piperidino]-2-(2-quinolylthio)ethanone Formula: C23H20FN3O2S MolecularWeight: 421.487203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NOC3=C2C=C(C=C3)F)C(=O)CSC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCC1C2=NOC3=C2C=C(C=C3)F)C(=O)CSC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H20FN3O2S/c24-17-6-7-20-18(13-17)23(26-29-20)16-9-11-27(12-10-16)22(28)14-30-21-8-5-15-3-1-2-4-19(15)25-21/h1-8,13,16H,9-12,14H2