Vitas-M small molecule compound
methyl (2Z)-2-({[5-bromo-2-(1H-tetrazol-1-yl)phenyl]carbonyl}imino)-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL309204
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2cc(Br)ccc2n2cnnn2)/sc1C
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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 C14H11BrN6O3S MW 423.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11BrN6O3S/c1-7-11(13(23)24-2)17-14(25-7)18-12(22)9-5-8(15)3-4-10(9)21-6-16-19-20-21/h3-6H,1-2H3,(H,17,18,22)InChIKey
APLKUFVYFQSLGJ-UHFFFAOYSA-NSynonyms
1401538-09-71401538097
CC1=C(N=C(S1)NC(=O)C2=C(C=CC(=C2)Br)N3C=NN=N3)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2cc(Br)ccc2n2cnnn2)sc1C
InChI=1SC14H11BrN6O3Sc1711(13(23)242)1714(257)1812(22)958(15)3410(9)21616192021h36H12H3(H171822)
methyl(2Z)2(((5bromo2(1Htetrazol1yl)phenyl)carbonyl)imino)5methyl23dihydro13thiazole4carboxylate
methyl2((5bromo2(tetrazol1yl)benzoyl)amino)5methyl13thiazole4carboxylate
MFCD28028792
ZINC000079480290
ZINC79480290
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