SMILES:
O=C1C2=C(NC(=O)C3(N2)SCCS3)c2ccccc21Molecular Processing
Molecular formula
C13H10N2O2S2
Molecular weight
290.37
Exact mass
290.0184
XLogP
1.4
TPSA
58.2
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
19
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
76.62
Supplementary Information
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