SMILES:
CCC/N=C1\SCC(=O)N1c1ccccc1Molecular Processing
Molecular formula
C12H14N2OS
Molecular weight
234.32
Exact mass
234.0827
XLogP
2.53
TPSA
32.67
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
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
0.333
Molar refractivity
68.98
Supplementary Information
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