phenyl (NE)-N-[1-[1-methyl-5-[(E)-C-methyl-N-phenoxyperoxysulfanyl-carbonimidoyl]pyrrol-2-yl]ethylidene]sulfamate

Systemtic Name: phenyl (NE)-N-[1-[1-methyl-5-[(E)-C-methyl-N-phenoxyperoxysulfanyl-carbonimidoyl]pyrrol-2-yl]ethylidene]sulfamate Openeye Name: phenyl (NE)-N-[1-[1-methyl-5-[(E)-C-methyl-N-phenoxyperoxysulfanyl-carbonimidoyl]pyrrol-2-yl]ethylidene]sulfamate CAS Name: (NE)-N-[1-[1-methyl-5-[(1E)-1-(phenoxydioxythio)iminoethyl]-2-pyrrolyl]ethylidene]sulfamic acid phenyl ester IUPAC Name: phenyl (NE)-N-[1-[1-methyl-5-[(E)-C-methyl-N-phenoxyperoxysulfanylcarbonimidoyl]pyrrol-2-yl]ethylidene]sulfamate Traditional Name: (NE)-N-[1-[1-methyl-5-[(E)-C-methyl-N-(phenoxyperoxythio)carbonimidoyl]pyrrol-2-yl]ethylidene]sulfamic acid phenyl ester Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NSOOOC1=CC=CC=C1)C2=CC=C(N2C)C(=NS(=O)(=O)OC3=CC=CC=C3)C

Isomeric SMILES

C/C(=N\SOOOC1=CC=CC=C1)/C2=CC=C(N2C)/C(=N/S(=O)(=O)OC3=CC=CC=C3)/C

InChI

InChI=1S/C21H21N3O6S2/c1-16(22-31-30-29-27-18-10-6-4-7-11-18)20-14-15-21(24(20)3)17(2)23-32(25,26)28-19-12-8-5-9-13-19/h4-15H,1-3H3/b22-16+,23-17+