Vitas-M small molecule compound
ethyl (2Z)-2-({(Z)-N-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]glycyl}imino)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL543645
SMILES CCOC(=O)c1cs/c(=N\C(=O)CNc2ccc3c(cc2=O)C(CCc2c3c(OC)c(c(c2)OC)OC)NC(=O)C)/[nH]1
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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 C29H32N4O8S MW 596.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O8S/c1-6-41-28(37)21-14-42-29(32-21)33-24(36)13-30-20-10-8-17-18(12-22(20)35)19(31-15(2)34)9-7-16-11-23(38-3)26(39-4)27(40-5)25(16)17/h8,10-12,14,19H,6-7,9,13H2,1-5H3,(H,30,35)(H,31,34)(H,32,33,36)InChIKey
IVGPAZDAWNXTRX-UHFFFAOYSA-NSynonyms
110209767
ethyl(2Z)2(((Z)N(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)glycyl)imino)23dihydro13thiazole4carboxylate
ethyl2((2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)acetyl)amino)13thiazole4carboxylate
InChI=1SC29H32N4O8Sc164128(37)21144229(3221)3324(36)1330201081718(1222(20)35)19(3115(2)34)97161123(383)26(394)27(405)25(16)17h810121419H67913H215H3(H3035)(H3134)(H323336)
MFCD31755888
ZINC000217886762
ZINC000252536537
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