[4-[2-[3-(2-thiophen-2-ylethylcarbamoylamino)propanoylamino]ethyl]phenyl] sulfamate

Systemtic Name: [4-[2-[3-(2-thiophen-2-ylethylcarbamoylamino)propanoylamino]ethyl]phenyl] sulfamate Openeye Name: [4-[2-[3-[2-(2-thienyl)ethylcarbamoylamino]propanoylamino]ethyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[2-[[1-oxo-3-[[oxo-(2-thiophen-2-ylethylamino)methyl]amino]propyl]amino]ethyl]phenyl] ester IUPAC Name: [4-[2-[3-(2-thiophen-2-ylethylcarbamoylamino)propanoylamino]ethyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[2-[3-[2-(2-thienyl)ethylcarbamoylamino]propanoylamino]ethyl]phenyl] ester Formula: C18H24N4O5S2 MolecularWeight: 440.53696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)NCCC(=O)NCCC2=CC=C(C=C2)OS(=O)(=O)N

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)NCCC(=O)NCCC2=CC=C(C=C2)OS(=O)(=O)N

InChI

InChI=1S/C18H24N4O5S2/c19-29(25,26)27-15-5-3-14(4-6-15)7-10-20-17(23)9-12-22-18(24)21-11-8-16-2-1-13-28-16/h1-6,13H,7-12H2,(H,20,23)(H2,19,25,26)(H2,21,22,24)