Vitas-M small molecule compound

methyl 2-methyl-5-{[(3-nitrophenyl)sulfonyl](pyridin-4-ylcarbonyl)amino}-1-benzofuran-3-carboxylate

Catalog ID
STK238335
SMILES COC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccncc1

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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 C23H17N3O8S MW 495.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O8S/c1-14-21(23(28)33-2)19-13-16(6-7-20(19)34-14)25(22(27)15-8-10-24-11-9-15)35(31,32)18-5-3-4-17(12-18)26(29)30/h3-13H,1-2H3
InChIKey
GXDIQPPTFSTBIU-UHFFFAOYSA-N
Synonyms
448213-33-0
448213330
CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3=CC=NC=C3)S(=O)(=O)C4=CC=CC(=C4)(N+)(=O)(O))C(=O)OC
COC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1cccc(c1)(N+)(=O)(O))C(=O)c1ccncc1
InChI=1SC23H17N3O8Sc11421(23(28)332)191316(6720(19)3414)25(22(27)158102411915)35(3132)1853417(1218)26(29)30h313H12H3
methyl2methyl5(((3nitrophenyl)sulfonyl)(pyridin4ylcarbonyl)amino)1benzofuran3carboxylate
METHYL2METHYL5((3NITROPHENYL)SULFONYL(PYRIDINE4CARBONYL)AMINO)1BENZOFURAN3CARBOXYLATE
METHYL2METHYL5(N((3NITROPHENYL)SULFONYL)ISONICOTINAMIDO)BENZOFURAN3CARBOXYLATE
MFCD02345833
ZINC000008765830
ZINC08765830
ZINC8765830

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.