Vitas-M small molecule compound
2-{[(6-amino-4-oxo-1,4-dihydropyrimidin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Catalog ID
STK684331
SMILES O=c1cc(N)[nH]c(n1)SCc1nc2ccccc2c(=O)[nH]1
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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 C13H11N5O2S MW 301.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5O2S/c14-9-5-11(19)18-13(16-9)21-6-10-15-8-4-2-1-3-7(8)12(20)17-10/h1-5H,6H2,(H,15,17,20)(H3,14,16,18,19)InChIKey
HGASZMPAFNWQFV-UHFFFAOYSA-NSynonyms
2(((6amino4oxo14dihydropyrimidin2yl)sulfanyl)methyl)quinazolin4(3H)one
2((6AMINO4OXO1HPYRIMIDIN2YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NC(=O)C=C(N3)N
InChI=1SC13H11N5O2Sc149511(19)1813(169)2161015842137(8)12(20)1710h15H6H2(H151720)(H314161819)
MFCD05260351
O=c1cc(N)(nH)c(n1)SCc1nc2ccccc2c(=O)(nH)1
ZINC000004642620
ZINC04642620
ZINC4642620
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