Vitas-M small molecule compound
2-({[5-(5-bromo-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK219072
SMILES Brc1ccc2c(c1)cc(o2)c1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1
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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 C20H14BrN5O2S MW 468.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN5O2S/c1-26-18(16-9-11-8-12(21)6-7-15(11)28-16)24-25-20(26)29-10-17-22-14-5-3-2-4-13(14)19(27)23-17/h2-9H,10H2,1H3,(H,22,23,27)InChIKey
SEPYHPUVJFTYOY-UHFFFAOYSA-NSynonyms
2(((5(5BROMO1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(1H)ONE
2(((5(5BROMO1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((5(5BROMO1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
Brc1ccc2c(c1)cc(o2)c1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC5=C(O4)C=CC(=C5)Br
InChI=1SC20H14BrN5O2Sc12618(16911812(21)6715(11)2816)242520(26)2910172214532413(14)19(27)2317h29H10H21H3(H222327)
MFCD06007075
ZINC000001065022
ZINC01065022
ZINC1065022
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