2-(3-nitropyrazol-1-yl)-1-thiomorpholin-4-yl-ethanone

Systemtic Name: 2-(3-nitropyrazol-1-yl)-1-thiomorpholin-4-yl-ethanone Openeye Name: 2-(3-nitropyrazol-1-yl)-1-thiomorpholino-ethanone CAS Name: 2-(3-nitro-1-pyrazolyl)-1-thiomorpholin-4-ylethanone IUPAC Name: 2-(3-nitropyrazol-1-yl)-1-thiomorpholin-4-ylethanone Traditional Name: 2-(3-nitropyrazol-1-yl)-1-thiomorpholino-ethanone Formula: C9H12N4O3S MolecularWeight: 256.28158

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)CN2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1CSCCN1C(=O)CN2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C9H12N4O3S/c14-9(11-3-5-17-6-4-11)7-12-2-1-8(10-12)13(15)16/h1-2H,3-7H2