Vitas-M small molecule compound
ethyl 4-(4-butylphenyl)-5-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]thiophene-3-carboxylate
Catalog ID
STK423821
SMILES CCCCc1ccc(cc1)c1c(C)sc(c1C(=O)OCC)NC(=O)CC12CC3CC(C2)CC(C1)C3
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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 C30H39NO3S MW 493.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39NO3S/c1-4-6-7-20-8-10-24(11-9-20)26-19(3)35-28(27(26)29(33)34-5-2)31-25(32)18-30-15-21-12-22(16-30)14-23(13-21)17-30/h8-11,21-23H,4-7,12-18H2,1-3H3,(H,31,32)InChIKey
MZNLSHXNNFPMND-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)CC34CC5CC(C3)CC(C5)C4)C
ETHYL2((1ADAMANTYLACETYL)AMINO)4(4BUTYLPHENYL)5METHYL3THIOPHENECARBOXYLATE
ETHYL2((2(1ADAMANTYL)ACETYL)AMINO)4(4BUTYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2ADAMANTANYLACETYLAMINO)4(4BUTYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ethyl4(4butylphenyl)5methyl2((tricyclo(3311~37~)dec1ylacetyl)amino)thiophene3carboxylate
InChI=1SC30H39NO3Sc14672081024(11920)2619(3)3528(27(26)29(33)3452)3125(32)183015211222(1630)1423(1321)1730h8112123H471218H213H3(H3132)
ZINC000008454513
ZINC08454513
ZINC8454513
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