Vitas-M small molecule compound

methyl {2-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]-6-oxo-3,6-dihydropyrimidin-4-yl}acetate

Catalog ID
STL150388
SMILES COC(=O)Cc1cc(=O)nc([nH]1)/N=c/1\sc2c([nH]1)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 C14H12N4O3S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O3S/c1-21-12(20)7-8-6-11(19)17-13(15-8)18-14-16-9-4-2-3-5-10(9)22-14/h2-6H,7H2,1H3,(H2,15,16,17,18,19)
InChIKey
FWFNWGMJJFDNRZ-UHFFFAOYSA-N
Synonyms
498570-86-8
498570868
COC(=O)CC1=CC(=O)N=C(N1)NC2=NC3=CC=CC=C3S2
COC(=O)Cc1cc(=O)nc((nH)1)N=c1sc2c((nH)1)cccc2
InChI=1SC14H12N4O3Sc12112(20)78611(19)1713(158)1814169423510(9)2214h26H7H21H3(H21516171819)
methyl(2((2Z)13benzothiazol2(3H)ylideneamino)6oxo36dihydropyrimidin4yl)acetate
METHYL2(2(13BENZOTHIAZOL2YLAMINO)4OXO1HPYRIMIDIN6YL)ACETATE
MFCD03795760
ZINC000017835360
ZINC17835360

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.