2-methyl-1-[4-(2-phenylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(2-phenylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-(2-phenylsulfanylpyridine-3-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-[2-(phenylthio)-3-pyridinyl]methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(2-phenylsulfanylpyridine-3-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[2-(phenylthio)nicotinoyl]piperazino]propan-1-one Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2S/c1-15(2)19(24)22-11-13-23(14-12-22)20(25)17-9-6-10-21-18(17)26-16-7-4-3-5-8-16/h3-10,15H,11-14H2,1-2H3