Vitas-M small molecule compound
2-({[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK289017
SMILES O=c1[nH]c(CSc2nnc(n2c2ccccc2)CN2CCOCC2)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 C22H22N6O2S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S/c29-21-17-8-4-5-9-18(17)23-19(24-21)15-31-22-26-25-20(14-27-10-12-30-13-11-27)28(22)16-6-2-1-3-7-16/h1-9H,10-15H2,(H,23,24,29)InChIKey
YWCJJGVPUCAAJL-UHFFFAOYSA-NSynonyms
2(((5(MORPHOLIN4YLMETHYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((5(morpholin4ylmethyl)4phenyl124triazol3yl)sulfanylmethyl)1Hquinazolin4one
C1COCCN1CC2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=O)C5=CC=CC=C5N4
InChI=1SC22H22N6O2Sc292117845918(17)2319(2421)153122262520(1427101230131127)28(22)166213716h19H1015H2(H232429)
MFCD09476145
O=c1(nH)c(CSc2nnc(n2c2ccccc2)CN2CCOCC2)nc2c1cccc2
ZINC000013945004
ZINC13945004
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