2-chloranyl-N-(4-methylsulfanyl-1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(4-methylsulfanyl-1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)-4-nitro-benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-(morpholine-4-carbonyl)propyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-(4-morpholinyl)-1-oxobutan-2-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-(4-methylsulfanyl-1-morpholin-4-yl-1-oxobutan-2-yl)-4-nitrobenzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-(morpholine-4-carbonyl)propyl]-4-nitro-benzamide Formula: C16H20ClN3O5S MolecularWeight: 401.8651

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCOCC1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CSCCC(C(=O)N1CCOCC1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H20ClN3O5S/c1-26-9-4-14(16(22)19-5-7-25-8-6-19)18-15(21)12-3-2-11(20(23)24)10-13(12)17/h2-3,10,14H,4-9H2,1H3,(H,18,21)