Vitas-M small molecule compound
2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl 2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK280182
SMILES O=C(c1c(sc2c1CCCC2)NC(=O)c1ccccc1)OCCn1c(C)ncc1[N+](=O)[O-]
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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 C22H22N4O5S MW 454.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O5S/c1-14-23-13-18(26(29)30)25(14)11-12-31-22(28)19-16-9-5-6-10-17(16)32-21(19)24-20(27)15-7-3-2-4-8-15/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,24,27)InChIKey
AFIFPZBHHQTRGA-UHFFFAOYSA-NSynonyms
299962-71-32(2methyl5nitro1Himidazol1yl)ethyl2((phenylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
2(2methyl5nitroimidazol1yl)ethyl2benzamido4567tetrahydro1benzothiophene3carboxylate
299962713
CC1=NC=C(N1CCOC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC22H22N4O5Sc114231318(26(29)30)25(14)11123122(28)19169561017(16)3221(19)2420(27)157324815h247813H56912H21H3(H2427)
MFCD00544556
O=C(c1c(sc2c1CCCC2)NC(=O)c1ccccc1)OCCn1c(C)ncc1(N+)(=O)(O)
ZINC000000850551
ZINC00850551
ZINC850551
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