Vitas-M small molecule compound
2-(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-N-(4-methylphenyl)acetamide
Catalog ID
STK245570
SMILES O=C(Cc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1)Nc1ccc(cc1)C
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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 C21H20N6O2S MW 420.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2S/c1-13-7-9-14(10-8-13)22-19(28)11-18-25-26-21(27(18)2)30-12-17-23-16-6-4-3-5-15(16)20(29)24-17/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,24,29)InChIKey
KZAQYYAFAKZDDV-UHFFFAOYSA-NSynonyms
2(4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)N(4METHYLPHENYL)ACETAMIDE
2(4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)N(4METHYLPHENYL)ACETAMIDE
2(4METHYL5(4OXO34DIHYDROQUINAZOLIN2YLMETHYLSULFANYL)4H(124)TRIAZOL3YL)NPTOLYLACETAMIDE
CC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC3=NC(=O)C4=CC=CC=C4N3
InChI=1SC21H20N6O2Sc1137914(10813)2219(28)1118252621(27(18)2)3012172316643515(16)20(29)2417h310H1112H212H3(H2228)(H232429)
MFCD08670176
O=C(Cc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1)Nc1ccc(cc1)C
ZINC000009327523
ZINC09327523
ZINC9327523
Check stock
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Check stock on Vitas-MAvailable files
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