Vitas-M small molecule compound

(1Z)-4,4,6-trimethyl-2-oxo-1-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-methoxybenzoate

Catalog ID
STK129808
SMILES COc1ccccc1C(=O)Oc1cc2/C(=C\3/SC(=S)NC3=O)/C(=O)N3c2c(c1)C(=CC3(C)C)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 C25H20N2O5S2 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S2/c1-12-11-25(2,3)27-19-15(12)9-13(32-23(30)14-7-5-6-8-17(14)31-4)10-16(19)18(22(27)29)20-21(28)26-24(33)34-20/h5-11H,1-4H3,(H,26,28,33)/b20-18-
InChIKey
WQUFYZTWNMMDRC-ZZEZOPTASA-N
Synonyms
578759-19-0
(1Z)446TRIMETHYL2OXO1(4OXO2SULFANYL13THIAZOL5(4H)YLIDENE)12DIHYDRO4HPYRROLO(321IJ)QUINOLIN8YL2METHOXYBENZOATE
(1Z)446TRIMETHYL2OXO1(4OXO2THIOXO13THIAZOLIDIN5YLIDENE)12DIHYDRO4HPYRROLO(321IJ)QUINOLIN8YL2METHOXYBENZOATE
(Z)446trimethyl2oxo1(4oxo2thioxothiazolidin5ylidene)24dihydro1Hpyrrolo(321ij)quinolin8yl2methoxybenzoate
578759190
CC1=CC(N2C3=C1C=C(C=C3C(=C4C(=O)NC(=S)S4)C2=O)OC(=O)C5=CC=CC=C5OC)(C)C
COc1ccccc1C(=O)Oc1cc2C(=C3SC(=S)NC3=O)C(=O)N3c2c(c1)C(=CC3(C)C)C
InChI=1SC25H20N2O5S2c1121125(23)271915(12)913(3223(30)14756817(14)314)1016(19)18(22(27)29)2021(28)2624(33)3420h511H14H3(H262833)b2018
MFCD03871987
ZINC12631220

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Available files

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