Vitas-M small molecule compound

2-methyl-3-(4-nitrophenyl)-4-oxo-4H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]phenylalaninate

Catalog ID
STL406466
SMILES Cc1ccc(cc1)S(=O)(=O)NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)[N+](=O)[O-])C)Cc1ccccc1

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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 C32H26N2O8S MW 598.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26N2O8S/c1-20-8-15-26(16-9-20)43(39,40)33-28(18-22-6-4-3-5-7-22)32(36)42-25-14-17-27-29(19-25)41-21(2)30(31(27)35)23-10-12-24(13-11-23)34(37)38/h3-17,19,28,33H,18H2,1-2H3
InChIKey
CCGZGKFTTHCIKS-UHFFFAOYSA-N
Synonyms

(2METHYL3(4NITROPHENYL)4OXOCHROMEN7YL)2((4METHYLPHENYL)SULFONYLAMINO)3PHENYLPROPANOATE
2methyl3(4nitrophenyl)4oxo4Hchromen7yl2(4methylphenylsulfonamido)3phenylpropanoate
2methyl3(4nitrophenyl)4oxo4Hchromen7ylN((4methylphenyl)sulfonyl)phenylalaninate
2METHYL3(4NITROPHENYL)4OXOCHROMEN7YL2(((4METHYLPHENYL)SULFONYL)AMINO)3PHENYLPROPANOATE
CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C)C5=CC=C(C=C5)(N+)(=O)(O)
Cc1ccc(cc1)S(=O)(=O)NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)(N+)(=O)(O))C)Cc1ccccc1
InChI=1SC32H26N2O8Sc12081526(16920)43(3940)3328(18226435722)32(36)422514172729(1925)4121(2)30(31(27)35)23101224(131123)34(37)38h317192833H18H212H3
MFCD01562768
ZINC000100732917
ZINC000100732920

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Available files

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