ethyl 1-[5-chloranyl-2-[2-(ethylamino)ethanoylamino]phenyl]sulfonylpyrrole-2-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-2-[2-(ethylamino)ethanoylamino]phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[5-chloro-2-[[2-(ethylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[5-chloro-2-[[2-(ethylamino)-1-oxoethyl]amino]phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-2-[[2-(ethylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[5-chloro-2-[[2-(ethylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C17H20ClN3O5S MolecularWeight: 413.8758

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC(=O)NC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

Isomeric SMILES

CCNCC(=O)NC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC

InChI

InChI=1S/C17H20ClN3O5S/c1-3-19-11-16(22)20-13-8-7-12(18)10-15(13)27(24,25)21-9-5-6-14(21)17(23)26-4-2/h5-10,19H,3-4,11H2,1-2H3,(H,20,22)