1-[[(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]pyrrolidin-2-yl]methyl]urea

Systemtic Name: 1-[[(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]pyrrolidin-2-yl]methyl]urea Openeye Name: [(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]pyrrolidin-2-yl]methylurea CAS Name: [(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]-2-pyrrolidinyl]methylurea IUPAC Name: [(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]pyrrolidin-2-yl]methylurea Traditional Name: [(2R,4R)-1-cyano-4-[(2,5-dimethoxyphenyl)sulfonylamino]pyrrolidin-2-yl]methylurea Formula: C15H21N5O5S MolecularWeight: 383.42274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2CC(N(C2)C#N)CNC(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N[C@@H]2C[C@@H](N(C2)C#N)CNC(=O)N

InChI

InChI=1S/C15H21N5O5S/c1-24-12-3-4-13(25-2)14(6-12)26(22,23)19-10-5-11(7-18-15(17)21)20(8-10)9-16/h3-4,6,10-11,19H,5,7-8H2,1-2H3,(H3,17,18,21)/t10-,11-/m1/s1