ethyl 5-azanyl-4-[(2R)-2-[4-(methylsulfonylmethyl)phenyl]pyrrolidin-1-yl]carbonyl-pyridine-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-[(2R)-2-[4-(methylsulfonylmethyl)phenyl]pyrrolidin-1-yl]carbonyl-pyridine-2-carboxylate Openeye Name: ethyl 5-amino-4-[(2R)-2-[4-(methylsulfonylmethyl)phenyl]pyrrolidine-1-carbonyl]pyridine-2-carboxylate CAS Name: 5-amino-4-[[(2R)-2-[4-(methylsulfonylmethyl)phenyl]-1-pyrrolidinyl]-oxomethyl]-2-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-[(2R)-2-[4-(methylsulfonylmethyl)phenyl]pyrrolidine-1-carbonyl]pyridine-2-carboxylate Traditional Name: 5-amino-4-[(2R)-2-[4-(mesylmethyl)phenyl]pyrrolidine-1-carbonyl]picolinic acid ethyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C(C(=C1)C(=O)N2CCCC2C3=CC=C(C=C3)CS(=O)(=O)C)N

Isomeric SMILES

CCOC(=O)C1=NC=C(C(=C1)C(=O)N2CCC[C@@H]2C3=CC=C(C=C3)CS(=O)(=O)C)N

InChI

InChI=1S/C21H25N3O5S/c1-3-29-21(26)18-11-16(17(22)12-23-18)20(25)24-10-4-5-19(24)15-8-6-14(7-9-15)13-30(2,27)28/h6-9,11-12,19H,3-5,10,13,22H2,1-2H3/t19-/m1/s1