Vitas-M small molecule compound
4-nitro-N-({1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}carbamothioyl)benzamide
Catalog ID
STK331211
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])NC(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-12(20-9-13-6-14(10-20)8-15(7-13)11-20)21-19(27)22-18(24)16-2-4-17(5-3-16)23(25)26/h2-5,12-15H,6-11H2,1H3,(H2,21,22,24,27)/t12?,13-,14+,15-,20?InChIKey
JCGCJMWKCGGMOK-UOBONFSKSA-NSynonyms
4nitroN((1((3s5s7s)tricyclo(3311~37~)dec1yl)ethyl)carbamothioyl)benzamide
MFCD02802686
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))NC(C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)C
ZINC000004657326
ZINC000004657327
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