Vitas-M small molecule compound
methyl (2Z)-2-{[3-(3-acetyl-1H-indol-1-yl)propanoyl]imino}-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL311072
SMILES COC(=O)c1[nH]/c(=N/C(=O)CCn2cc(c3c2cccc3)C(=O)C)/sc1CC(C)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 C22H25N3O4S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4S/c1-13(2)11-18-20(21(28)29-4)24-22(30-18)23-19(27)9-10-25-12-16(14(3)26)15-7-5-6-8-17(15)25/h5-8,12-13H,9-11H2,1-4H3,(H,23,24,27)InChIKey
ZIHLYGIHEMBGIB-UHFFFAOYSA-NSynonyms
1401535-38-31401535383
CC(C)CC1=C(N=C(S1)NC(=O)CCN2C=C(C3=CC=CC=C32)C(=O)C)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)CCn2cc(c3c2cccc3)C(=O)C)sc1CC(C)C
InChI=1SC22H25N3O4Sc113(2)111820(21(28)294)2422(3018)2319(27)910251216(14(3)26)15756817(15)25h581213H911H214H3(H232427)
methyl(2Z)2((3(3acetyl1Hindol1yl)propanoyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylate
methyl2(3(3acetylindol1yl)propanoylamino)5(2methylpropyl)13thiazole4carboxylate
MFCD28025892
ZINC000079490507
ZINC79490507
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