Vitas-M small molecule compound
3-(4-nitrophenyl)-4-oxo-4H-chromen-7-yl 6-{[(4-methylphenyl)sulfonyl]amino}hexanoate
Catalog ID
STL026588
SMILES O=C(Oc1ccc2c(c1)occ(c2=O)c1ccc(cc1)[N+](=O)[O-])CCCCCNS(=O)(=O)c1ccc(cc1)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 C28H26N2O8S MW 550.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O8S/c1-19-6-13-23(14-7-19)39(35,36)29-16-4-2-3-5-27(31)38-22-12-15-24-26(17-22)37-18-25(28(24)32)20-8-10-21(11-9-20)30(33)34/h6-15,17-18,29H,2-5,16H2,1H3InChIKey
SPKLRHGXKJKXES-UHFFFAOYSA-NSynonyms
(3(4NITROPHENYL)4OXOCHROMEN7YL)6((4METHYLPHENYL)SULFONYLAMINO)HEXANOATE
3(4nitrophenyl)4oxo4Hchromen7yl6(((4methylphenyl)sulfonyl)amino)hexanoate
3(4nitrophenyl)4oxo4Hchromen7yl6(4methylphenylsulfonamido)hexanoate
CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC28H26N2O8Sc11961323(14719)39(3536)2916423527(31)382212152426(1722)371825(28(24)32)2081021(11920)30(33)34h615171829H2516H21H3
MFCD01560531
O=C(Oc1ccc2c(c1)occ(c2=O)c1ccc(cc1)(N+)(=O)(O))CCCCCNS(=O)(=O)c1ccc(cc1)C
ZINC000001899005
ZINC01899005
ZINC1899005
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