Vitas-M small molecule compound
2-({[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK211585
SMILES C=CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1c1ccccc1F
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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 C20H16FN5OS MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16FN5OS/c1-2-11-26-18(13-7-3-5-9-15(13)21)24-25-20(26)28-12-17-22-16-10-6-4-8-14(16)19(27)23-17/h2-10H,1,11-12H2,(H,22,23,27)InChIKey
AWGMUARKDAEZCW-UHFFFAOYSA-NSynonyms
2(((5(2FLUOROPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((5(2FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
2(4ALLYL5(2FLUOROPHENYL)4H(124)TRIAZOL3YLSULFANYLMETHYL)3HQUINAZOLIN4ONE
C=CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4F
C=CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1c1ccccc1F
InChI=1SC20H16FN5OSc12112618(13735915(13)21)242520(26)28121722161064814(16)19(27)2317h210H11112H2(H222327)
MFCD07394988
ZINC000004741676
ZINC04741676
ZINC4741676
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