Vitas-M small molecule compound

methyl 2-{[(Z)-(2,4-dioxo-2H-chromen-3(4H)-ylidene)methyl]amino}-1,3-benzothiazole-6-carboxylate

Catalog ID
STK898834
SMILES COC(=O)c1ccc2c(c1)sc(n2)N/C=C/1\C(=O)Oc2c(C1=O)cccc2

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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 C19H12N2O5S MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N2O5S/c1-25-17(23)10-6-7-13-15(8-10)27-19(21-13)20-9-12-16(22)11-4-2-3-5-14(11)26-18(12)24/h2-9H,1H3,(H,20,21)/b12-9-
InChIKey
IROLRPGRQBDKDX-XFXZXTDPSA-N
Synonyms

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC=C3C(=O)C4=CC=CC=C4OC3=O
COC(=O)c1ccc2c(c1)sc(n2)NC=C1C(=O)Oc2c(C1=O)cccc2
InChI=1SC19H12N2O5Sc12517(23)10671315(810)2719(2113)2091216(22)11423514(11)2618(12)24h29H1H3(H2021)b129
methyl2(((Z)(24dioxo2Hchromen3(4H)ylidene)methyl)amino)13benzothiazole6carboxylate
methyl2(((Z)(24dioxochromen3ylidene)methyl)amino)13benzothiazole6carboxylate
MFCD18173163
ZINC000044827557
ZINC44827557

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Available files

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