Vitas-M small molecule compound
7-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-tert-butyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Catalog ID
STL265579
SMILES O=C(c1ccc(cc1)Br)CSc1sc2n(n1)c(=O)c(nn2)C(C)(C)C
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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 C16H15BrN4O2S2 MW 439.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O2S2/c1-16(2,3)12-13(23)21-14(19-18-12)25-15(20-21)24-8-11(22)9-4-6-10(17)7-5-9/h4-7H,8H2,1-3H3InChIKey
VSMSIBVQVZFCKQ-UHFFFAOYSA-NSynonyms
7((2(4bromophenyl)2oxoethyl)sulfanyl)3tertbutyl4H(134)thiadiazolo(23c)(124)triazin4one
7((2(4BROMOPHENYL)2OXOETHYL)THIO)3TERTBUTYL4H(134)THIADIAZOLO(23C)(124)TRIAZIN4ONE
7(2(4BROMOPHENYL)2OXOETHYL)SULFANYL3TERTBUTYL(134)THIADIAZOLO(23C)(124)TRIAZIN4ONE
CC(C)(C)C1=NN=C2N(C1=O)N=C(S2)SCC(=O)C3=CC=C(C=C3)Br
InChI=1SC16H15BrN4O2S2c116(23)1213(23)2114(191812)2515(2021)24811(22)94610(17)759h47H8H213H3
MFCD03088007
ZINC000000622866
ZINC00622866
ZINC622866
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