2-phthalazin-1-ylsulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-phthalazin-1-ylsulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-phthalazin-1-ylsulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-(1-phthalazinylthio)-1-(1-piperidinyl)ethanone IUPAC Name: 2-phthalazin-1-ylsulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-(phthalazin-1-ylthio)-1-piperidino-ethanone Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=CC3=CC=CC=C32

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=CC3=CC=CC=C32

InChI

InChI=1S/C15H17N3OS/c19-14(18-8-4-1-5-9-18)11-20-15-13-7-3-2-6-12(13)10-16-17-15/h2-3,6-7,10H,1,4-5,8-9,11H2