N-[2-(diethylamino)-2-oxidanylidene-ethyl]-2-(2-fluorophenyl)sulfanyl-N-methyl-5-nitro-benzamide

Systemtic Name: N-[2-(diethylamino)-2-oxidanylidene-ethyl]-2-(2-fluorophenyl)sulfanyl-N-methyl-5-nitro-benzamide Openeye Name: N-[2-(diethylamino)-2-oxo-ethyl]-2-(2-fluorophenyl)sulfanyl-N-methyl-5-nitro-benzamide CAS Name: N-[2-(diethylamino)-2-oxoethyl]-2-[(2-fluorophenyl)thio]-N-methyl-5-nitrobenzamide IUPAC Name: N-[2-(diethylamino)-2-oxoethyl]-2-(2-fluorophenyl)sulfanyl-N-methyl-5-nitrobenzamide Traditional Name: N-[2-(diethylamino)-2-keto-ethyl]-2-[(2-fluorophenyl)thio]-N-methyl-5-nitro-benzamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(C)C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2F

Isomeric SMILES

CCN(CC)C(=O)CN(C)C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2F

InChI

InChI=1S/C20H22FN3O4S/c1-4-23(5-2)19(25)13-22(3)20(26)15-12-14(24(27)28)10-11-17(15)29-18-9-7-6-8-16(18)21/h6-12H,4-5,13H2,1-3H3