methyl 2-[[3-(cyclobutylamino)-5-pyrrolidin-1-ylsulfonyl-phenyl]carbonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[3-(cyclobutylamino)-5-pyrrolidin-1-ylsulfonyl-phenyl]carbonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[3-(cyclobutylamino)-5-pyrrolidin-1-ylsulfonyl-benzoyl]-methyl-amino]acetate CAS Name: 2-[[[3-(cyclobutylamino)-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(cyclobutylamino)-5-pyrrolidin-1-ylsulfonylbenzoyl]-methylamino]acetate Traditional Name: 2-[[3-(cyclobutylamino)-5-pyrrolidinosulfonyl-benzoyl]-methyl-amino]acetic acid methyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCCC2)NC3CCC3

Isomeric SMILES

CN(CC(=O)OC)C(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCCC2)NC3CCC3

InChI

InChI=1S/C19H27N3O5S/c1-21(13-18(23)27-2)19(24)14-10-16(20-15-6-5-7-15)12-17(11-14)28(25,26)22-8-3-4-9-22/h10-12,15,20H,3-9,13H2,1-2H3