Vitas-M small molecule compound
2-({[5-(2-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK230958
SMILES COc1ccccc1c1nnc(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 C19H17N5O2S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O2S/c1-24-17(13-8-4-6-10-15(13)26-2)22-23-19(24)27-11-16-20-14-9-5-3-7-12(14)18(25)21-16/h3-10H,11H2,1-2H3,(H,20,21,25)InChIKey
PCGWGXFQDHGTFN-UHFFFAOYSA-NSynonyms
2(((5(2methoxyphenyl)4methyl4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(2METHOXYPHENYL)4METHYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
2(5(2METHOXYPHENYL)4METHYL4H(124)TRIAZOL3YLSULFANYLMETHYL)3HQUINAZOLIN4ONE
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4OC
COc1ccccc1c1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC19H17N5O2Sc12417(138461015(13)262)222319(24)2711162014953712(14)18(25)2116h310H11H212H3(H202125)
MFCD05536571
ZINC000004736353
ZINC04736353
ZINC4736353
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