Vitas-M small molecule compound
4-[2-(3,4-diethoxyphenyl)ethyl]-5-(1,2,3,4-tetrahydro-9H-carbazol-9-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306830
SMILES CCOc1cc(CCn2c(S)nnc2Cn2c3CCCCc3c3c2cccc3)ccc1OCC
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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 C27H32N4O2S MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O2S/c1-3-32-24-14-13-19(17-25(24)33-4-2)15-16-30-26(28-29-27(30)34)18-31-22-11-7-5-9-20(22)21-10-6-8-12-23(21)31/h5,7,9,11,13-14,17H,3-4,6,8,10,12,15-16,18H2,1-2H3,(H,29,34)InChIKey
RTJJHUXGKNZLIB-UHFFFAOYSA-NSynonyms
828285-27-44(2(34diethoxyphenyl)ethyl)3(1234tetrahydrocarbazol9ylmethyl)1H124triazole5thione
4(2(34diethoxyphenyl)ethyl)5(1234tetrahydro9Hcarbazol9ylmethyl)4H124triazole3thiol
828285274
CCOC1=C(C=C(C=C1)CCN2C(=NNC2=S)CN3C4=C(CCCC4)C5=CC=CC=C53)OCC
InChI=1SC27H32N4O2Sc133224141319(1725(24)3342)15163026(282927(30)34)1831221175920(22)2110681223(21)31h57911131417H34681012151618H212H3(H2934)
MFCD04053641
ZINC000002791973
ZINC02791973
ZINC2791973
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