Vitas-M small molecule compound
2-(benzylsulfanyl)-N-(2-bromo-4-nitrophenyl)-5-chloropyrimidine-4-carboxamide
Catalog ID
STK823713
SMILES O=C(c1nc(ncc1Cl)SCc1ccccc1)Nc1ccc(cc1Br)[N+](=O)[O-]
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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 C18H12BrClN4O3S MW 479.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrClN4O3S/c19-13-8-12(24(26)27)6-7-15(13)22-17(25)16-14(20)9-21-18(23-16)28-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,22,25)InChIKey
BARPQSCILXRIDB-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)N(2bromo4nitrophenyl)5chloropyrimidine4carboxamide
2benzylsulfanylN(2bromo4nitrophenyl)5chloropyrimidine4carboxamide
C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=C(C=C(C=C3)(N+)(=O)(O))Br)Cl
InChI=1SC18H12BrClN4O3Sc1913812(24(26)27)6715(13)2217(25)1614(20)92118(2316)2810114213511h19H10H2(H2225)
MFCD03464219
O=C(c1nc(ncc1Cl)SCc1ccccc1)Nc1ccc(cc1Br)(N+)(=O)(O)
ZINC000027020812
ZINC27020812
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