CN=C(NC#N)SC
SMILES: CN=C(NC#N)SC

Molecular Processing

Molecular formula
C4H7N3S
Molecular weight
129.19
Exact mass
129.0361
XLogP
0.41
TPSA
48.18
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
35.62

Supplementary Information

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