phenyl 4-acetamido-3-[propan-2-yloxycarbonyl-[(E)-N'-propan-2-yloxycarbonylcarbamimidoyl]amino]benzenesulfonate

Systemtic Name: phenyl 4-acetamido-3-[propan-2-yloxycarbonyl-[(E)-N'-propan-2-yloxycarbonylcarbamimidoyl]amino]benzenesulfonate Openeye Name: phenyl 4-acetamido-3-[isopropoxycarbonyl-[(E)-N'-isopropoxycarbonylcarbamimidoyl]amino]benzenesulfonate CAS Name: 4-acetamido-3-[[(E)-amino-[oxo(propan-2-yloxy)methyl]iminomethyl]-[oxo(propan-2-yloxy)methyl]amino]benzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-acetamido-3-[propan-2-yloxycarbonyl-[(E)-N'-propan-2-yloxycarbonylcarbamimidoyl]amino]benzenesulfonate Traditional Name: 4-acetamido-3-[isopropoxycarbonyl-[(E)-N'-isopropoxycarbonylamidino]amino]benzenesulfonic acid phenyl ester Formula: C23H28N4O8S MolecularWeight: 520.55542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N=C(N)N(C1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC=C2)NC(=O)C)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)/N=C(\N)/N(C1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC=C2)NC(=O)C)C(=O)OC(C)C

InChI

InChI=1S/C23H28N4O8S/c1-14(2)33-22(29)26-21(24)27(23(30)34-15(3)4)20-13-18(11-12-19(20)25-16(5)28)36(31,32)35-17-9-7-6-8-10-17/h6-15H,1-5H3,(H,25,28)(H2,24,26,29)