2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide

Systemtic Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide Openeye Name: 2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]-N-(4-nitrophenyl)propanamide CAS Name: 2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide Traditional Name: 2-[(5-morpholinosulfonyl-2-pyridyl)thio]-N-(4-nitrophenyl)propionamide Formula: C18H20N4O6S2 MolecularWeight: 452.5046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H20N4O6S2/c1-13(18(23)20-14-2-4-15(5-3-14)22(24)25)29-17-7-6-16(12-19-17)30(26,27)21-8-10-28-11-9-21/h2-7,12-13H,8-11H2,1H3,(H,20,23)