Vitas-M small molecule compound
propan-2-yl 2-{[2-(4-ethylphenoxy)propanoyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Catalog ID
STK437104
SMILES CCc1ccc(cc1)OC(C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCCCCCCCC2)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 C29H41NO4S MW 499.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H41NO4S/c1-5-22-16-18-23(19-17-22)34-21(4)27(31)30-28-26(29(32)33-20(2)3)24-14-12-10-8-6-7-9-11-13-15-25(24)35-28/h16-21H,5-15H2,1-4H3,(H,30,31)InChIKey
SMAHPOXPQGHIQW-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)OC(C)C(=O)NC2=C(C3=C(S2)CCCCCCCCCC3)C(=O)OC(C)C
InChI=1SC29H41NO4Sc1522161823(191722)3421(4)27(31)302826(29(32)3320(2)3)24141210867911131525(24)3528h1621H515H214H3(H3031)
MFCD03944524
propan2yl2((2(4ethylphenoxy)propanoyl)amino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
propan2yl2(2(4ethylphenoxy)propanoylamino)45678910111213decahydrocyclododeca(b)thiophene3carboxylate
ZINC000020192671
ZINC000020192673
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