Vitas-M small molecule compound
2-[2-chloro-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]-N-phenylacetamide
Catalog ID
STL389029
SMILES O=C(Nc1ccccc1)COc1ccc(cc1Cl)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
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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 C31H32ClNO5 MW 534.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32ClNO5/c1-30(2)13-21(34)28-24(15-30)38-25-16-31(3,4)14-22(35)29(25)27(28)18-10-11-23(20(32)12-18)37-17-26(36)33-19-8-6-5-7-9-19/h5-12,27H,13-17H2,1-4H3,(H,33,36)InChIKey
GZOLNJSFKONOFL-UHFFFAOYSA-NSynonyms
2(2chloro4(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)phenoxy)Nphenylacetamide
2(2chloro4(3366tetramethyl18dioxo4579tetrahydro2Hxanthen9yl)phenoxy)Nphenylacetamide
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC(=O)NC5=CC=CC=C5)Cl)C(=O)C1)C
InChI=1SC31H32ClNO5c130(2)1321(34)2824(1530)38251631(34)1422(35)29(25)27(28)18101123(20(32)1218)371726(36)33198657919h51227H1317H214H3(H3336)
MFCD04090055
ZINC000000987411
ZINC00987411
ZINC987411
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