Vitas-M small molecule compound

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

Catalog ID
STK700971
SMILES O=C(C(NS(=O)(=O)c1ccc(cc1)C)C)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)[N+](=O)[O-])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 C26H22N2O8S MW 522.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O8S/c1-15-4-11-21(12-5-15)37(33,34)27-16(2)26(30)36-20-10-13-22-23(14-20)35-17(3)24(25(22)29)18-6-8-19(9-7-18)28(31)32/h4-14,16,27H,1-3H3
InChIKey
RUUZMHMJARZKEC-UHFFFAOYSA-N
Synonyms
1396966-63-4
(2METHYL3(4NITROPHENYL)4OXOCHROMEN7YL)2((4METHYLPHENYL)SULFONYLAMINO)PROPANOATE
1396966634
2(TOLUENE4SULFONYLAMINO)PROPIONICACID2METHYL3(4NITROPHENYL)4OXO4HCHROMEN7YLESTER
2methyl3(4nitrophenyl)4oxo4Hchromen7yl2(4methylphenylsulfonamido)propanoate
2methyl3(4nitrophenyl)4oxo4Hchromen7ylN((4methylphenyl)sulfonyl)alaninate
2METHYL3(4NITROPHENYL)4OXOCHROMEN7YL2(((4METHYLPHENYL)SULFONYL)AMINO)PROPANOATE
CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC26H22N2O8Sc11541121(12515)37(3334)2716(2)26(30)362010132223(1420)3517(3)24(25(22)29)186819(9718)28(31)32h4141627H13H3
MFCD01564946
O=C(C(NS(=O)(=O)c1ccc(cc1)C)C)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)(N+)(=O)(O))C
ZINC000008691501
ZINC000008691502

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Available files

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