CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2(CC2)C#N)OS(=O)(=O)C
الاسم: tert-butyl 2-[(1-cyanocyclopropyl)carbamoyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate
SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2(CC2)C#N)OS(=O)(=O)C

Molecular Processing

Molecular formula
C15H23N3O6S
Molecular weight
373.43
Exact mass
373.1308
XLogP
0.51
TPSA
125.8
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
25
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
86.78

Supplementary Information

InChIKey: SPNCLCLCEXSWHE-UHFFFAOYSA-N
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