Vitas-M small molecule compound
4-[5-(3-chloro-2-methylphenyl)-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl benzoate
Catalog ID
STL045162
SMILES COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1cccc(c1)[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 C32H24ClN3O8 MW 614.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24ClN3O8/c1-18-23(33)12-7-13-24(18)34-30(37)27-28(35(44-29(27)31(34)38)21-10-6-11-22(17-21)36(40)41)20-14-15-25(26(16-20)42-2)43-32(39)19-8-4-3-5-9-19/h3-17,27-29H,1-2H3InChIKey
SUUFERUYZMLAHJ-UHFFFAOYSA-NSynonyms
(4(5(3CHLORO2METHYLPHENYL)2(3NITROPHENYL)46DIOXO3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)BENZOATE
4(5(3chloro2methylphenyl)2(3nitrophenyl)46dioxohexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenylbenzoate
4(5(3CHLORO2METHYLPHENYL)2(3NITROPHENYL)46DIOXOHEXAHYDRO2HPYRROLO(34D)ISOXAZOL3YL)2METHOXYPHENYLBENZOATE
CC1=C(C=CC=C1Cl)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=CC(=C(C=C5)OC(=O)C6=CC=CC=C6)OC
COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1cccc(c1)(N+)(=O)(O)
InChI=1SC32H24ClN3O8c11823(33)1271324(18)3430(37)2728(35(4429(27)31(34)38)211061122(1721)36(40)41)20141525(26(1620)422)4332(39)198435919h3172729H12H3
MFCD04074146
ZINC000102877567
ZINC000227076604
Check stock
See real-time availability and sample size for STL045162 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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