[4-(2-hydroxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone CAS Name: [4-(2-hydroxyethyl)-1-piperazinyl]-[2-(phenylthio)-3-pyridinyl]methanone IUPAC Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(2-hydroxyethyl)piperazino]-[2-(phenylthio)-3-pyridyl]methanone Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCO)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2S/c22-14-13-20-9-11-21(12-10-20)18(23)16-7-4-8-19-17(16)24-15-5-2-1-3-6-15/h1-8,22H,9-14H2