Vitas-M small molecule compound
azepan-1-yl[4-(benzyloxy)-3-methoxyphenyl]methanethione
Catalog ID
STK221443
SMILES COc1cc(ccc1OCc1ccccc1)C(=S)N1CCCCCC1
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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 C21H25NO2S MW 355.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO2S/c1-23-20-15-18(21(25)22-13-7-2-3-8-14-22)11-12-19(20)24-16-17-9-5-4-6-10-17/h4-6,9-12,15H,2-3,7-8,13-14,16H2,1H3InChIKey
GXXKEESEYBLAJK-UHFFFAOYSA-NSynonyms
AZEPAN1YL(3METHOXY4PHENYLMETHOXYPHENYL)METHANETHIONE
azepan1yl(4(benzyloxy)3methoxyphenyl)methanethione
COC1=C(C=CC(=C1)C(=S)N2CCCCCC2)OCC3=CC=CC=C3
InChI=1SC21H25NO2Sc123201518(21(25)221372381422)111219(20)24161795461017h4691215H2378131416H21H3
MFCD08680746
ZINC000004816028
ZINC04816028
ZINC4816028
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