Vitas-M small molecule compound
4-chloro-N-[2-(4-ethyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK219039
SMILES CCn1c(CCNC(=O)c2ccc(cc2)Cl)nnc1SCc1nc2ccccc2c(=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 C22H21ClN6O2S MW 468.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN6O2S/c1-2-29-19(11-12-24-20(30)14-7-9-15(23)10-8-14)27-28-22(29)32-13-18-25-17-6-4-3-5-16(17)21(31)26-18/h3-10H,2,11-13H2,1H3,(H,24,30)(H,25,26,31)InChIKey
OTMLQJJYAYBEDY-UHFFFAOYSA-NSynonyms
4CHLORON(2(4ETHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4CHLORON(2(4ETHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCNC(=O)C4=CC=C(C=C4)Cl
CCn1c(CCNC(=O)c2ccc(cc2)Cl)nnc1SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC22H21ClN6O2Sc122919(11122420(30)147915(23)10814)272822(29)3213182517643516(17)21(31)2618h310H21113H21H3(H2430)(H252631)
MFCD07189205
ZINC000009302395
ZINC09302395
ZINC9302395
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