2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-1-piperidino-ethanone Formula: C21H20FN3OS MolecularWeight: 381.466403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3OS/c22-16-10-8-15(9-11-16)20-17-6-2-3-7-18(17)21(24-23-20)27-14-19(26)25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-14H2