2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-morpholin-4-yl-ethanone

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-morpholin-4-yl-ethanone Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-morpholino-ethanone CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanyl-1-morpholin-4-ylethanone Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]-1-morpholino-ethanone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N3CCOCC3

InChI

InChI=1S/C17H21N3O2S/c1-13-17(23-12-16(21)19-8-10-22-11-9-19)14(2)20(18-13)15-6-4-3-5-7-15/h3-7H,8-12H2,1-2H3