Vitas-M small molecule compound
2-({[5-(4-methoxybenzyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STL122266
SMILES COc1ccc(cc1)Cc1nnc(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 C20H19N5O2S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2S/c1-25-18(11-13-7-9-14(27-2)10-8-13)23-24-20(25)28-12-17-21-16-6-4-3-5-15(16)19(26)22-17/h3-10H,11-12H2,1-2H3,(H,21,22,26)InChIKey
XKYGRKSUOZSBSN-UHFFFAOYSA-NSynonyms
2(((5(4methoxybenzyl)4methyl4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2(((5(4METHOXYBENZYL)4METHYL4H124TRIAZOL3YL)THIO)METHYL)4(3H)QUINAZOLINONE
2((5((4METHOXYPHENYL)METHYL)4METHYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CC4=CC=C(C=C4)OC
COc1ccc(cc1)Cc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC20H19N5O2Sc12518(11137914(272)10813)232420(25)2812172116643515(16)19(26)2217h310H1112H212H3(H212226)
MFCD06006574
ZINC000008762917
ZINC08762917
ZINC8762917
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