Vitas-M small molecule compound
(3Z)-3-({5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Catalog ID
STK686878
SMILES Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccc(o2)COc2c(C)cccc2Cl)/c2c1cc(cc2[N+](=O)[O-])[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 C28H22ClN3O8S MW 596.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O8S/c1-17-6-10-23(11-7-17)41(37,38)30-15-19(27-25(30)13-20(31(33)34)14-26(27)32(35)36)12-21-8-9-22(40-21)16-39-28-18(2)4-3-5-24(28)29/h3-14H,15-16H2,1-2H3/b19-12+InChIKey
MOWSNXIQAJCAJF-XDHOZWIPSA-NSynonyms
(3Z)3((5((2chloro6methylphenoxy)methyl)furan2yl)methylidene)1((4methylphenyl)sulfonyl)46dinitro23dihydro1Hindole
(3Z)3((5((2CHLORO6METHYLPHENOXY)METHYL)FURAN2YL)METHYLIDENE)1(4METHYLPHENYL)SULFONYL46DINITRO2HINDOLE
CC1=CC=C(C=C1)S(=O)(=O)N2CC(=CC3=CC=C(O3)COC4=C(C=CC=C4Cl)C)C5=C(C=C(C=C52)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc(cc1)S(=O)(=O)N1CC(=Cc2ccc(o2)COc2c(C)cccc2Cl)c2c1cc(cc2(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC28H22ClN3O8Sc11761023(11717)41(3738)301519(2725(30)1320(31(33)34)1426(27)32(35)36)12218922(4021)16392818(2)43524(28)29h314H1516H212H3b1912+
MFCD06616621
ZINC000100202360
ZINC100202360
Check stock
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Check stock on Vitas-MAvailable files
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