SMILES:
CC/N=C1\SCC(=O)N1c1cccc(C)c1CMolecular Processing
Molecular formula
C13H16N2OS
Molecular weight
248.35
Exact mass
248.0983
XLogP
2.76
TPSA
32.67
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
73.84
Supplementary Information
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