Vitas-M small molecule compound
2-({[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STL122271
SMILES C=CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1c1cc2c(o1)cccc2
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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 C22H17N5O2S MW 415.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O2S/c1-2-11-27-20(18-12-14-7-3-6-10-17(14)29-18)25-26-22(27)30-13-19-23-16-9-5-4-8-15(16)21(28)24-19/h2-10,12H,1,11,13H2,(H,23,24,28)InChIKey
OMAYZWDDCYWYMS-UHFFFAOYSA-NSynonyms
2(((5(1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(1BENZOFURAN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
C=CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC5=CC=CC=C5O4
C=CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1c1cc2c(o1)cccc2
InChI=1SC22H17N5O2Sc12112720(1812147361017(14)2918)252622(27)3013192316954815(16)21(28)2419h21012H11113H2(H232428)
MFCD18434644
ZINC000033768349
ZINC33768349
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