CC(C)(C)OC(=O)NC1C=NC=CS1
Название: tert-butyl N-(2H-1,4-thiazin-2-yl)carbamate
SMILES: CC(C)(C)OC(=O)NC1C=NC=CS1

Molecular Processing

Molecular formula
C9H14N2O2S
Molecular weight
214.29
Exact mass
214.0776
XLogP
2.13
TPSA
50.69
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
58.38

Supplementary Information

InChIKey: KBMPTUADLDFNRD-UHFFFAOYSA-N
Синонимы
SCHEMBL8373668KBMPTUADLDFNRD-UHFFFAOYSA-N3-t-butoxycarbonylamino-4-thia-pyridine
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