Vitas-M small molecule compound
2-[({4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]quinazolin-4(3H)-one
Catalog ID
STK230275
SMILES Cc1ccccc1OCc1nnc(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/c1-13-7-3-6-10-16(13)27-11-18-23-24-20(25(18)2)28-12-17-21-15-9-5-4-8-14(15)19(26)22-17/h3-10H,11-12H2,1-2H3,(H,21,22,26)InChIKey
YBUTZOQPCRXWRV-UHFFFAOYSA-NSynonyms
2(((4METHYL5((2METHYLPHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((4METHYL5((2METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
CC1=CC=CC=C1OCC2=NN=C(N2C)SCC3=NC(=O)C4=CC=CC=C4N3
Cc1ccccc1OCc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC20H19N5O2Sc1137361016(13)271118232420(25(18)2)2812172115954814(15)19(26)2217h310H1112H212H3(H212226)
MFCD07789636
ZINC000013571365
ZINC13571365
ZINC18222159
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