Vitas-M small molecule compound
(2E)-2-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}-3-methoxybenzylidene)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STK037079
SMILES CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)/C=N/NC(=S)NCC=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 C26H35N3O4S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35N3O4S/c1-4-6-7-8-16-31-22-10-12-23(13-11-22)32-17-18-33-24-14-9-21(19-25(24)30-3)20-28-29-26(34)27-15-5-2/h5,9-14,19-20H,2,4,6-8,15-18H2,1,3H3,(H2,27,29,34)/b28-20+InChIKey
XKGVRGSWRJEUHY-VFCFBJKWSA-NSynonyms
(2E)2(4(2(4(HEXYLOXY)PHENOXY)ETHOXY)3METHOXYBENZYLIDENE)N(PROP2EN1YL)HYDRAZINECARBOTHIOAMIDE
1((E)(4(2(4hexoxyphenoxy)ethoxy)3methoxyphenyl)methylideneamino)3prop2enylthiourea
CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=NNC(=S)NCC=C)OC
CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)C=NNC(=S)NCC=C
InChI=1SC26H35N3O4Sc14678163122101223(131122)321718332414921(1925(24)303)20282926(34)271552h59141920H24681518H213H3(H2272934)b2820+
MFCD02206951
STK037079
ZINC000013942124
ZINC83328794
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