2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[2-[(5-methylisoxazol-3-yl)methylsulfanyl]benzoyl]piperazin-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[[2-[(5-methyl-3-isoxazolyl)methylthio]phenyl]-oxomethyl]-1-piperazinyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoyl]piperazin-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-[2-[(5-methylisoxazol-3-yl)methylthio]benzoyl]piperazino]-1-morpholino-ethanone Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C22H28N4O4S/c1-17-14-18(23-30-17)16-31-20-5-3-2-4-19(20)22(28)26-8-6-24(7-9-26)15-21(27)25-10-12-29-13-11-25/h2-5,14H,6-13,15-16H2,1H3