5-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propylsulfanyl]thiophene-2-carbaldehyde

Systemtic Name: 5-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propylsulfanyl]thiophene-2-carbaldehyde Openeye Name: 5-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]propylsulfanyl]thiophene-2-carbaldehyde CAS Name: 5-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]propylthio]-2-thiophenecarboxaldehyde IUPAC Name: 5-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propylsulfanyl]thiophene-2-carbaldehyde Traditional Name: 5-[3-[4-(6-fluoroindoxazen-3-yl)piperidino]propylthio]thiophene-2-carbaldehyde Formula: C20H21FN2O2S2 MolecularWeight: 404.521343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCCSC4=CC=C(S4)C=O

Isomeric SMILES

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCCSC4=CC=C(S4)C=O

InChI

InChI=1S/C20H21FN2O2S2/c21-15-2-4-17-18(12-15)25-22-20(17)14-6-9-23(10-7-14)8-1-11-26-19-5-3-16(13-24)27-19/h2-5,12-14H,1,6-11H2