SpectraBase Compound ID | Iz0GSutNHRg |
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InChI | InChI=1S/C11H8N4S/c1-2-5-9-8(4-1)14-11(16-9)15-10-12-6-3-7-13-10/h1-7H,(H,12,13,14,15) |
InChIKey | CJTOFJMUMLSNLZ-UHFFFAOYSA-N |
Mol Weight | 228.27 g/mol |
Molecular Formula | C11H8N4S |
Exact Mass | 228.046967 g/mol |
SpectraBase Spectrum ID | J9OjfIfAOiM |
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Name | N-(Pyrimidin-2-yl)-1,3-benzothiazol-2-amine |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 228.046967448 u |
Formula | C11H8N4S |
InChI | InChI=1S/C11H8N4S/c1-2-5-9-8(4-1)14-11(16-9)15-10-12-6-3-7-13-10/h1-7H,(H,12,13,14,15) |
InChIKey | CJTOFJMUMLSNLZ-UHFFFAOYSA-N |
Molecular Weight | 228.273 g/mol |
SMILES | C1=CN=C(N=C1)NC1=NC=2C=CC=CC2S1 |