Vitas-M small molecule compound
N-[2-(4-ethyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]-4-methoxybenzamide
Catalog ID
STK218636
SMILES COc1ccc(cc1)C(=O)NCCc1nnc(n1CC)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 C23H24N6O3S MW 464.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O3S/c1-3-29-20(12-13-24-21(30)15-8-10-16(32-2)11-9-15)27-28-23(29)33-14-19-25-18-7-5-4-6-17(18)22(31)26-19/h4-11H,3,12-14H2,1-2H3,(H,24,30)(H,25,26,31)InChIKey
CCJYRKAVFMIODQ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCNC(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=O)NCCc1nnc(n1CC)SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC23H24N6O3Sc132920(12132421(30)1581016(322)11915)272823(29)3314192518754617(18)22(31)2619h411H31214H212H3(H2430)(H252631)
MFCD07189172
N(2(4ETHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
N(2(4ETHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
ZINC000009263224
ZINC09263224
ZINC9263224
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