Vitas-M small molecule compound
N-(2,3-dimethylphenyl)azepane-1-carbothioamide
Catalog ID
STK493994
SMILES S=C(N1CCCCCC1)Nc1cccc(c1C)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 C15H22N2S MW 262.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N2S/c1-12-8-7-9-14(13(12)2)16-15(18)17-10-5-3-4-6-11-17/h7-9H,3-6,10-11H2,1-2H3,(H,16,18)InChIKey
BPLUNJBDYDXNJJ-UHFFFAOYSA-NSynonyms
AZAPERHYDROEPINYL((23DIMETHYLPHENYL)AMINO)METHANE1THIONE
CC1=C(C(=CC=C1)NC(=S)N2CCCCCC2)C
InChI=1SC15H22N2Sc11287914(13(12)2)1615(18)171053461117h79H361011H212H3(H1618)
MFCD03492982
N(23dimethylphenyl)azepane1carbothioamide
ZINC000007522253
ZINC07522253
ZINC7522253
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