1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-thiomorpholin-4-yl-ethane-1,2-dione

Systemtic Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-thiomorpholin-4-yl-ethane-1,2-dione Openeye Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-thiomorpholino-ethane-1,2-dione CAS Name: 1-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-thiomorpholin-4-ylethane-1,2-dione IUPAC Name: 1-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-thiomorpholin-4-ylethane-1,2-dione Traditional Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-thiomorpholino-ethane-1,2-dione Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCSCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCSCC3

InChI

InChI=1S/C17H19N3O2S/c1-12-15(16(21)17(22)19-8-10-23-11-9-19)13(2)20(18-12)14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3