CN(C)S(=O)(=O)c1cc(Cl)c(Cl)c(Cl)c1SCSC#N
名称: 3,4,5-trichloro-N,N-dimethyl-2-((thiocyanomethyl)thio)benzenesulfonamide
SMILES: CN(C)S(=O)(=O)c1cc(Cl)c(Cl)c(Cl)c1SCSC#N

Molecular Processing

Molecular formula
C10H9Cl3N2O2S3
Molecular weight
391.75
Exact mass
389.8892
XLogP
4.16
TPSA
61.17
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
86.27

Supplementary Information

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