Vitas-M small molecule compound
2-({[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STL364362
SMILES O=c1[nH]c(CSc2nnc(n2c2ccccc2)c2cc3c(o2)cccc3)nc2c1cccc2
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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 C25H17N5O2S MW 451.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N5O2S/c31-24-18-11-5-6-12-19(18)26-22(27-24)15-33-25-29-28-23(30(25)17-9-2-1-3-10-17)21-14-16-8-4-7-13-20(16)32-21/h1-14H,15H2,(H,26,27,31)InChIKey
LXPGFGLVSVBHQD-UHFFFAOYSA-NSynonyms
2(((5(1benzofuran2yl)4phenyl4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(1benzofuran2yl)4phenyl124triazol3yl)sulfanylmethyl)1Hquinazolin4one
C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=O)C4=CC=CC=C4N3)C5=CC6=CC=CC=C6O5
InChI=1SC25H17N5O2Sc31241811561219(18)2622(2724)153325292823(30(25)1792131017)2114168471320(16)3221h114H15H2(H262731)
MFCD09426766
O=c1(nH)c(CSc2nnc(n2c2ccccc2)c2cc3c(o2)cccc3)nc2c1cccc2
ZINC000009189749
ZINC09189749
ZINC9189749
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