Vitas-M small molecule compound
2-{[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Catalog ID
STK310638
SMILES O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nccc(n1)c1ccc(cc1)Br
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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 C18H13BrN4O3S MW 445.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN4O3S/c19-13-6-4-12(5-7-13)16-8-9-20-18(22-16)27-11-17(24)21-14-2-1-3-15(10-14)23(25)26/h1-10H,11H2,(H,21,24)InChIKey
BOXDQGZJCGSGGM-UHFFFAOYSA-NSynonyms
832129-46-12((4(4bromophenyl)pyrimidin2yl)sulfanyl)N(3nitrophenyl)acetamide
2(4(4bromophenyl)pyrimidin2yl)sulfanylN(3nitrophenyl)acetamide
832129461
C1=CC(=CC(=C1)(N+)(=O)(O))NC(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)Br
InChI=1SC18H13BrN4O3Sc19136412(5713)16892018(2216)271117(24)211421315(1014)23(25)26h110H11H2(H2124)
MFCD04054272
O=C(Nc1cccc(c1)(N+)(=O)(O))CSc1nccc(n1)c1ccc(cc1)Br
ZINC000002805465
ZINC02805465
ZINC2805465
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