Name: 2-(1-benzyl-5-methyl-4-imidazolyl)-1,3-dithian-5-one
SMILES:
Cc1c(C2SCC(=O)CS2)ncn1Cc1ccccc1Molecular Processing
Molecular formula
C15H16N2OS2
Molecular weight
304.44
Exact mass
304.0704
XLogP
3.29
TPSA
34.89
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
85.17
Supplementary Information
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Involved in 4 reactions→