Vitas-M small molecule compound

2-({2-[4-(butan-2-yloxy)phenoxy]ethyl}sulfanyl)quinazolin-4(3H)-one

Catalog ID
STK094242
SMILES CCC(Oc1ccc(cc1)OCCSc1nc2ccccc2c(=O)[nH]1)C

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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 C20H22N2O3S MW 370.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S/c1-3-14(2)25-16-10-8-15(9-11-16)24-12-13-26-20-21-18-7-5-4-6-17(18)19(23)22-20/h4-11,14H,3,12-13H2,1-2H3,(H,21,22,23)
InChIKey
BGHWHLIISDBXPJ-UHFFFAOYSA-N
Synonyms

2((2(4(BUTAN2YLOXY)PHENOXY)ETHYL)SULFANYL)QUINAZOLIN4(1H)ONE
2((2(4(BUTAN2YLOXY)PHENOXY)ETHYL)SULFANYL)QUINAZOLIN4(3H)ONE
2((2(4SECBUTOXYPHENOXY)ETHYL)SULFANYL)4(1H)QUINAZOLINONE
2((2(4SECBUTOXYPHENOXY)ETHYL)THIO)QUINAZOLIN4(1H)ONE
2(2(4(METHYLPROPOXY)PHENOXY)ETHYLTHIO)HYDROQUINAZOLIN4ONE
2(2(4BUTAN2YLOXYPHENOXY)ETHYLSULFANYL)1HQUINAZOLIN4ONE
2(2(4SECBUTOXYPHENOXY)ETHYLSULFANYL)1HQUINAZOLIN4ONE
CCC(C)OC1=CC=C(C=C1)OCCSC2=NC(=O)C3=CC=CC=C3N2
CCC(Oc1ccc(cc1)OCCSc1nc2ccccc2c(=O)(nH)1)C
InChI=1SC20H22N2O3Sc1314(2)251610815(91116)24121326202118754617(18)19(23)2220h41114H31213H212H3(H212223)
MFCD01931130
STK094242
ZINC000018142952
ZINC000018142955

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.