Vitas-M small molecule compound
2-({5-[4-(acetylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylbenzyl)acetamide
Catalog ID
STK154205
SMILES O=C(NCc1ccc(cc1)C)CSc1nnc(n1C)c1ccc(cc1)NC(=O)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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-14-4-6-16(7-5-14)12-22-19(28)13-29-21-25-24-20(26(21)3)17-8-10-18(11-9-17)23-15(2)27/h4-11H,12-13H2,1-3H3,(H,22,28)(H,23,27)InChIKey
IBEDXWUZBORYEL-UHFFFAOYSA-NSynonyms
2((5(4(ACETYLAMINO)PHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(4METHYLBENZYL)ACETAMIDE
2((5(4ACETAMIDOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N((4METHYLPHENYL)METHYL)ACETAMIDE
CC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)C
InChI=1SC21H23N5O2Sc1144616(7514)122219(28)132921252420(26(21)3)1781018(11917)2315(2)27h411H1213H213H3(H2228)(H2327)
MFCD03876687
ZINC000001142513
ZINC01142513
ZINC1142513
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