ethyl 4-[2-[3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenoxy]sulfonylphenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenoxy]sulfonylphenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenoxy]sulfonylphenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[2-[3-[carbamimidoyl(propoxy)amino]oxy-5-methylphenoxy]sulfonylphenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[carbamimidoyl(propoxy)amino]oxy-5-methylphenoxy]sulfonylphenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[2-[3-[amidino(propoxy)amino]oxy-5-methyl-phenoxy]sulfonylphenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C24H33N5O9S2 MolecularWeight: 599.67692

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Descriptors Computed from Structure

Canonical SMILES:

CCCON(C(=N)N)OC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCON(C(=N)N)OC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C24H33N5O9S2/c1-4-14-36-29(23(25)26)37-19-15-18(3)16-20(17-19)38-40(33,34)22-9-7-6-8-21(22)39(31,32)28-12-10-27(11-13-28)24(30)35-5-2/h6-9,15-17H,4-5,10-14H2,1-3H3,(H3,25,26)