Vitas-M small molecule compound

N-[(2E)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide

Catalog ID
STK654576
SMILES COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)/N=c/1\[nH]nc(s1)C1CC1

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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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-9-12(8-15(23)20-19-22-21-17(28-19)10-4-5-10)18(24)27-14-7-11(25-2)6-13(26-3)16(9)14/h6-7,10H,4-5,8H2,1-3H3,(H,20,22,23)
InChIKey
TXOZBPOYMPPGNS-UHFFFAOYSA-N
Synonyms
1144472-65-0
1144472650
CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)NC3=NN=C(S3)C4CC4
COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N=c1(nH)nc(s1)C1CC1
InChI=1SC19H19N3O5Sc1912(815(23)2019222117(2819)104510)18(24)2714711(252)613(263)16(9)14h6710H458H213H3(H202223)
MFCD18167071
N((2E)5cyclopropyl134thiadiazol2(3H)ylidene)2(57dimethoxy4methyl2oxo2Hchromen3yl)acetamide
N(5cyclopropyl134thiadiazol2yl)2(57dimethoxy4methyl2oxochromen3yl)acetamide
ZINC000031813391
ZINC31813391

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Available files

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