[(3S)-1-(5-nitropyridin-2-yl)piperidin-3-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [(3S)-1-(5-nitropyridin-2-yl)piperidin-3-yl]-thiomorpholin-4-yl-methanone Openeye Name: [(3S)-1-(5-nitro-2-pyridyl)-3-piperidyl]-thiomorpholino-methanone CAS Name: [(3S)-1-(5-nitro-2-pyridinyl)-3-piperidinyl]-thiomorpholin-4-ylmethanone IUPAC Name: [(3S)-1-(5-nitropyridin-2-yl)piperidin-3-yl]-thiomorpholin-4-ylmethanone Traditional Name: [(3S)-1-(5-nitro-2-pyridyl)-3-piperidyl]-thiomorpholino-methanone Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)N3CCSCC3

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)N3CCSCC3

InChI

InChI=1S/C15H20N4O3S/c20-15(17-6-8-23-9-7-17)12-2-1-5-18(11-12)14-4-3-13(10-16-14)19(21)22/h3-4,10,12H,1-2,5-9,11H2/t12-/m0/s1