Vitas-M small molecule compound
2-({[5-(7-methoxy-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
STL122272
SMILES C=CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1c1oc2c(c1)cccc2OC
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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 C23H19N5O3S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O3S/c1-3-11-28-21(18-12-14-7-6-10-17(30-2)20(14)31-18)26-27-23(28)32-13-19-24-16-9-5-4-8-15(16)22(29)25-19/h3-10,12H,1,11,13H2,2H3,(H,24,25,29)InChIKey
LSLUUFLDLYIEBU-UHFFFAOYSA-NSynonyms
2(((5(7methoxy1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(7METHOXY1BENZOFURAN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
C=CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1c1oc2c(c1)cccc2OC
COC1=CC=CC2=C1OC(=C2)C3=NN=C(N3CC=C)SCC4=NC(=O)C5=CC=CC=C5N4
InChI=1SC23H19N5O3Sc13112821(181214761017(302)20(14)3118)262723(28)3213192416954815(16)22(29)2519h31012H11113H22H3(H242529)
MFCD18434645
ZINC000034828018
ZINC34828018
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