Vitas-M small molecule compound
2-[({5-[(2,5-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]quinazolin-4(3H)-one
Catalog ID
STK245574
SMILES CCn1c(nnc1COc1cc(C)ccc1C)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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-4-27-20(12-29-18-11-14(2)9-10-15(18)3)25-26-22(27)30-13-19-23-17-8-6-5-7-16(17)21(28)24-19/h5-11H,4,12-13H2,1-3H3,(H,23,24,28)InChIKey
PRGHZPYNXFTNBZ-UHFFFAOYSA-NSynonyms
2(((5((25DIMETHYLPHENOXY)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((5((25DIMETHYLPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)COC4=C(C=CC(=C4)C)C
CCn1c(nnc1COc1cc(C)ccc1C)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC22H23N5O2Sc142720(1229181114(2)91015(18)3)252622(27)3013192317865716(17)21(28)2419h511H41213H213H3(H232428)
MFCD08670180
ZINC000009327531
ZINC09327531
ZINC9327531
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