N-[3-[(E)-C-methyl-N-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)amino]carbonimidoyl]phenyl]ethanamide

Systemtic Name: N-[3-[(E)-C-methyl-N-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)amino]carbonimidoyl]phenyl]ethanamide Openeye Name: N-[3-[(E)-C-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-anilino)carbonimidoyl]phenyl]acetamide CAS Name: N-[3-[(1E)-1-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazinylidene]ethyl]phenyl]acetamide IUPAC Name: N-[3-[(E)-C-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonylanilino)carbonimidoyl]phenyl]acetamide Traditional Name: N-[3-[(E)-C-methyl-N-(2-nitro-4-pyrrolidinosulfonyl-anilino)carbonimidoyl]phenyl]acetamide Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])/C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C20H23N5O5S/c1-14(16-6-5-7-17(12-16)21-15(2)26)22-23-19-9-8-18(13-20(19)25(27)28)31(29,30)24-10-3-4-11-24/h5-9,12-13,23H,3-4,10-11H2,1-2H3,(H,21,26)/b22-14+