[3-[(2R,4R)-4-[[2,5-bis(bromanyl)phenyl]sulfonylamino]-1-cyano-pyrrolidin-2-yl]-2-methyl-phenyl]-methyl-carbamic acid

Systemtic Name: [3-[(2R,4R)-4-[[2,5-bis(bromanyl)phenyl]sulfonylamino]-1-cyano-pyrrolidin-2-yl]-2-methyl-phenyl]-methyl-carbamic acid Openeye Name: [3-[(2R,4R)-1-cyano-4-[(2,5-dibromophenyl)sulfonylamino]pyrrolidin-2-yl]-2-methyl-phenyl]-methyl-carbamic acid CAS Name: [3-[(2R,4R)-1-cyano-4-[(2,5-dibromophenyl)sulfonylamino]-2-pyrrolidinyl]-2-methylphenyl]-methylcarbamic acid IUPAC Name: [3-[(2R,4R)-1-cyano-4-[(2,5-dibromophenyl)sulfonylamino]pyrrolidin-2-yl]-2-methylphenyl]-methylcarbamic acid Traditional Name: [3-[(2R,4R)-1-cyano-4-[(2,5-dibromophenyl)sulfonylamino]pyrrolidin-2-yl]-2-methyl-phenyl]-methyl-carbamic acid Formula: C20H20Br2N4O4S MolecularWeight: 572.2702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N(C)C(=O)O)C2CC(CN2C#N)NS(=O)(=O)C3=C(C=CC(=C3)Br)Br

Isomeric SMILES

CC1=C(C=CC=C1N(C)C(=O)O)[C@H]2C[C@H](CN2C#N)NS(=O)(=O)C3=C(C=CC(=C3)Br)Br

InChI

InChI=1S/C20H20Br2N4O4S/c1-12-15(4-3-5-17(12)25(2)20(27)28)18-9-14(10-26(18)11-23)24-31(29,30)19-8-13(21)6-7-16(19)22/h3-8,14,18,24H,9-10H2,1-2H3,(H,27,28)/t14-,18-/m1/s1