Vitas-M small molecule compound
methyl [(2E)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
Catalog ID
STL041615
SMILES COc1ccc(cc1)/C=C/c1n[nH]/c(=N\C(=O)OC)/s1
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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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-18-10-6-3-9(4-7-10)5-8-11-15-16-12(20-11)14-13(17)19-2/h3-8H,1-2H3,(H,14,16,17)/b8-5+InChIKey
XQQTYWRRWPSJJH-VMPITWQZSA-NSynonyms
1164548-33-7(5((E)2(4METHOXYPHENYL)VINYL)(134)THIADIAZOL2YL)CARBAMICACIDMETHYLESTER
1164548337
COC1=CC=C(C=C1)C=CC2=NN=C(S2)NC(=O)OC
COc1ccc(cc1)C=Cc1n(nH)c(=NC(=O)OC)s1
InChI=1SC13H13N3O3Sc11810639(4710)5811151612(2011)1413(17)192h38H12H3(H141617)b85+
methyl((2E)5((E)2(4methoxyphenyl)ethenyl)134thiadiazol2(3H)ylidene)carbamate
METHYLN(5((E)2(4METHOXYPHENYL)ETHENYL)134THIADIAZOL2YL)CARBAMATE
MFCD05730260
ZINC000095544900
ZINC95544900
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