Vitas-M small molecule compound
(5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL378849
SMILES Cc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
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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 C23H15ClN2O7S MW 498.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClN2O7S/c1-12-2-4-15(17(6-12)26(29)30)18-5-3-14(33-18)8-21-22(27)25(23(28)34-21)10-13-7-19-20(9-16(13)24)32-11-31-19/h2-9H,10-11H2,1H3/b21-8+InChIKey
VJBFQPMSFKOLJR-ODCIPOBUSA-NSynonyms
(5E)3((6chloro13benzodioxol5yl)methyl)5((5(4methyl2nitrophenyl)furan2yl)methylidene)13thiazolidine24dione
CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=O)S3)CC4=CC5=C(C=C4Cl)OCO5)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=C1SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
InChI=1SC23H15ClN2O7Sc1122415(17(612)26(29)30)185314(3318)82122(27)25(23(28)3421)101371920(916(13)24)32113119h29H1011H21H3b218+
MFCD03614403
ZINC000001411641
ZINC01411641
ZINC1411641
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