Vitas-M small molecule compound
2-({[5-(3-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK230906
SMILES C=CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1c1cccc(c1)F
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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/c1-2-10-26-18(13-6-5-7-14(21)11-13)24-25-20(26)28-12-17-22-16-9-4-3-8-15(16)19(27)23-17/h2-9,11H,1,10,12H2,(H,22,23,27)InChIKey
VNMSOSPBYFGLPH-UHFFFAOYSA-NSynonyms
2(((5(3fluorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((5(3FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
2(4ALLYL5(3FLUOROPHENYL)4H(124)TRIAZOL3YLSULFANYLMETHYL)3HQUINAZOLIN4ONE
C=CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC(=CC=C4)F
C=CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1c1cccc(c1)F
InChI=1SC20H16FN5OSc12102618(1365714(21)1113)242520(26)2812172216943815(16)19(27)2317h2911H11012H2(H222327)
MFCD07791694
ZINC000004736316
ZINC04736316
ZINC4736316
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