Vitas-M small molecule compound
2-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 3-(1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK265847
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C(C1)c1ccccc1
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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 C37H31NO8S MW 649.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31NO8S/c1-22-10-16-29(17-11-22)47(43,44)46-28-14-12-24(13-15-28)32(39)21-45-37(42)25-8-5-9-27(18-25)38-35(40)33-26-19-30(23-6-3-2-4-7-23)31(20-26)34(33)36(38)41/h2-18,26,30-31,33-34H,19-21H2,1H3InChIKey
GOOCAWJKASOQSF-UHFFFAOYSA-NSynonyms
2(4(((4methylphenyl)sulfonyl)oxy)phenyl)2oxoethyl3(13dioxo5phenyloctahydro2H47methanoisoindol2yl)benzoate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=CC=C3)N4C(=O)C5C6CC(C5C4=O)C(C6)C7=CC=CC=C7
InChI=1SC37H31NO8Sc122101629(171122)47(4344)4628141224(131528)32(39)214537(42)2585927(1825)3835(40)33261930(236324723)31(2026)34(33)36(38)41h2182630313334H1921H21H3
MFCD04042366
ZINC000150418469
ZINC000239306221
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