[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [2-keto-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl] ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C1=CC=CS1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H22N2O5S2/c1-14(17-5-4-12-27-17)20-18(22)13-26-19(23)15-6-8-16(9-7-15)28(24,25)21-10-2-3-11-21/h4-9,12,14H,2-3,10-11,13H2,1H3,(H,20,22)/t14-/m0/s1