ethyl 4-[[(2R)-1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(2R)-1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(2R)-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[(2R)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2R)-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[(2R)-1-[(5-chloro-2-thienyl)sulfonyl]prolyl]amino]benzoic acid ethyl ester Formula: C18H19ClN2O5S2 MolecularWeight: 442.93686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H19ClN2O5S2/c1-2-26-18(23)12-5-7-13(8-6-12)20-17(22)14-4-3-11-21(14)28(24,25)16-10-9-15(19)27-16/h5-10,14H,2-4,11H2,1H3,(H,20,22)/t14-/m1/s1