Vitas-M small molecule compound
(2Z)-2-[(4-{[2-(1H-indol-1-yl)ethyl]amino}-4-oxobutanoyl)imino]-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylic acid
Catalog ID
STL313718
SMILES CC(Cc1s/c(=N\C(=O)CCC(=O)NCCn2ccc3c2cccc3)/[nH]c1C(=O)O)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 C22H26N4O4S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S/c1-14(2)13-17-20(21(29)30)25-22(31-17)24-19(28)8-7-18(27)23-10-12-26-11-9-15-5-3-4-6-16(15)26/h3-6,9,11,14H,7-8,10,12-13H2,1-2H3,(H,23,27)(H,29,30)(H,24,25,28)InChIKey
HSJIQGAVFDXNCY-UHFFFAOYSA-NSynonyms
1435980-49-6(2Z)2((4((2(1Hindol1yl)ethyl)amino)4oxobutanoyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylicacid
1435980496
2((4(2indol1ylethylamino)4oxobutanoyl)amino)5(2methylpropyl)13thiazole4carboxylicacid
CC(C)CC1=C(N=C(S1)NC(=O)CCC(=O)NCCN2C=CC3=CC=CC=C32)C(=O)O
CC(Cc1sc(=NC(=O)CCC(=O)NCCn2ccc3c2cccc3)(nH)c1C(=O)O)C
InChI=1SC22H26N4O4Sc114(2)131720(21(29)30)2522(3117)2419(28)8718(27)2310122611915534616(15)26h3691114H78101213H212H3(H2327)(H2930)(H242528)
MFCD28030275
ZINC000095475788
ZINC95475788
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