Vitas-M small molecule compound
methyl 2-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK442082
SMILES COC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1c(C)onc1c1ccccc1Cl
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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 C23H23ClN2O4S MW 458.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN2O4S/c1-13-18(20(26-30-13)14-9-7-8-11-16(14)24)21(27)25-22-19(23(28)29-2)15-10-5-3-4-6-12-17(15)31-22/h7-9,11H,3-6,10,12H2,1-2H3,(H,25,27)InChIKey
NUJFFMSJEGTTIG-UHFFFAOYSA-NSynonyms
CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=C(C4=C(S3)CCCCCC4)C(=O)OC
InChI=1SC23H23ClN2O4Sc11318(20(263013)149781116(14)24)21(27)252219(23(28)292)151053461217(15)3122h7911H361012H212H3(H2527)
methyl2(((3(2chlorophenyl)5methyl12oxazol4yl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((3(2chlorophenyl)5methyl12oxazole4carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD03381000
ZINC000002755447
ZINC02755447
ZINC2755447
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