N-[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanamide

Systemtic Name: N-[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanamide Openeye Name: N-[(3R)-1,1-dioxothiolan-3-yl]-2-(4-methylsulfonyl-2-nitro-anilino)acetamide CAS Name: N-[(3R)-1,1-dioxo-3-thiolanyl]-2-(4-methylsulfonyl-2-nitroanilino)acetamide IUPAC Name: N-[(3R)-1,1-dioxothiolan-3-yl]-2-(4-methylsulfonyl-2-nitroanilino)acetamide Traditional Name: N-[(3R)-1,1-diketothiolan-3-yl]-2-(4-mesyl-2-nitro-anilino)acetamide Formula: C13H17N3O7S2 MolecularWeight: 391.41998

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)NC2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)N[C@@H]2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O7S2/c1-24(20,21)10-2-3-11(12(6-10)16(18)19)14-7-13(17)15-9-4-5-25(22,23)8-9/h2-3,6,9,14H,4-5,7-8H2,1H3,(H,15,17)/t9-/m1/s1