N-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-methyl-4-nitro-benzamide

Systemtic Name: N-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-methyl-4-nitro-benzamide Openeye Name: N-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl]-N-ethyl-3-methyl-4-nitro-benzamide CAS Name: N-[2-[[(3S)-1,1-dioxo-3-thiolanyl]amino]-2-oxoethyl]-N-ethyl-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl]-N-ethyl-3-methyl-4-nitrobenzamide Traditional Name: N-[2-[[(3S)-1,1-diketothiolan-3-yl]amino]-2-keto-ethyl]-N-ethyl-3-methyl-4-nitro-benzamide Formula: C16H21N3O6S MolecularWeight: 383.41944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1CCS(=O)(=O)C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H21N3O6S/c1-3-18(9-15(20)17-13-6-7-26(24,25)10-13)16(21)12-4-5-14(19(22)23)11(2)8-12/h4-5,8,13H,3,6-7,9-10H2,1-2H3,(H,17,20)/t13-/m0/s1