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

Systemtic Name: ethyl 1-[5-chloranyl-2-[2-(cyclopropylamino)ethanoylamino]phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[5-chloro-2-[[2-(cyclopropylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[5-chloro-2-[[2-(cyclopropylamino)-1-oxoethyl]amino]phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-2-[[2-(cyclopropylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[5-chloro-2-[[2-(cyclopropylamino)acetyl]amino]phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C18H20ClN3O5S MolecularWeight: 425.8865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)CNC3CC3

Isomeric SMILES

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)CNC3CC3

InChI

InChI=1S/C18H20ClN3O5S/c1-2-27-18(24)15-4-3-9-22(15)28(25,26)16-10-12(19)5-8-14(16)21-17(23)11-20-13-6-7-13/h3-5,8-10,13,20H,2,6-7,11H2,1H3,(H,21,23)