Vitas-M small molecule compound
methyl O-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)-N-(phenylcarbonyl)tyrosinate
Catalog ID
STK670884
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2)CC(C(=O)OC)NC(=O)c2ccccc2)sc2c1CCCC2
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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 C30H32N2O7S MW 564.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O7S/c1-3-38-30(36)26-22-11-7-8-12-24(22)40-28(26)32-25(33)18-39-21-15-13-19(14-16-21)17-23(29(35)37-2)31-27(34)20-9-5-4-6-10-20/h4-6,9-10,13-16,23H,3,7-8,11-12,17-18H2,1-2H3,(H,31,34)(H,32,33)InChIKey
RORBERQYRKOCAH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=C(C=C3)CC(C(=O)OC)NC(=O)C4=CC=CC=C4
ethyl2((2(4(2benzamido3methoxy3oxopropyl)phenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC30H32N2O7Sc133830(36)262211781224(22)4028(26)3225(33)183921151319(141621)1723(29(35)372)3127(34)2095461020h46910131623H37811121718H212H3(H3134)(H3233)
methylO(2((3(ethoxycarbonyl)4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)N(phenylcarbonyl)tyrosinate
MFCD00746485
ZINC000059677145
ZINC000059677150
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