CS[SH]1N=C(SC#N)C(c2ccccc2)=N1
SMILES: CS[SH]1N=C(SC#N)C(c2ccccc2)=N1

Molecular Processing

Molecular formula
C10H9N3S3
Molecular weight
267.4
Exact mass
266.9959
XLogP
3.21
TPSA
48.51
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
76.12

Supplementary Information

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