CCS(=O)(=O)c1ccc(N)cc1C#N
SMILES: CCS(=O)(=O)c1ccc(N)cc1C#N

Molecular Processing

Molecular formula
C9H10N2O2S
Molecular weight
210.26
Exact mass
210.0463
XLogP
0.93
TPSA
83.95
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
53.3

Supplementary Information

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