Vitas-M small molecule compound
(10Z)-7-(4-fluorophenyl)-10-(4-hydroxy-3-iodo-5-nitrobenzylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK078801
SMILES Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C/c1cc(I)c(c(c1)[N+](=O)[O-])O)/s3)c1c(CC2)cccc1
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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 C27H17FIN3O4S MW 625.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17FIN3O4S/c28-17-8-5-16(6-9-17)24-19-10-7-15-3-1-2-4-18(15)23(19)30-27-31(24)26(34)22(37-27)13-14-11-20(29)25(33)21(12-14)32(35)36/h1-6,8-9,11-13,24,33H,7,10H2/b22-13-InChIKey
JIURSMXRPSUOMS-XKZIYDEJSA-NSynonyms
(10Z)7(4FLUOROPHENYL)10(4HYDROXY3IODO5NITROBENZYLIDENE)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)7(4fluorophenyl)10(4hydroxy3iodo5nitrobenzylidene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)F)C(=O)C(=CC6=CC(=C(C(=C6)I)O)(N+)(=O)(O))S4
Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1cc(I)c(c(c1)(N+)(=O)(O))O)s3)c1c(CC2)cccc1
InChI=1SC27H17FIN3O4Sc28178516(6917)241910715312418(15)23(19)302731(24)26(34)22(3727)13141120(29)25(33)21(1214)32(35)36h168911132433H710H2b2213
MFCD03664715
STK078801
ZINC000150411396
ZINC000150411402
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.