Vitas-M small molecule compound
2-[4-methyl-5-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-N-phenylacetamide
Catalog ID
STK136658
SMILES O=C(Nc1ccc(cc1)C)CSc1nnc(n1C)CC(=O)Nc1ccccc1
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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-14-8-10-16(11-9-14)22-19(27)13-28-20-24-23-17(25(20)2)12-18(26)21-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,21,26)(H,22,27)InChIKey
MBRJCSDIBPCQKQ-UHFFFAOYSA-NSynonyms
2((5(2ANILINO2OXOETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2(4METHYL5((2((4METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)NPHENYLACETAMIDE
2(4METHYL5(2(4METHYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)NPHENYLACETAMIDE
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC=CC=C3
InChI=1SC20H21N5O2Sc11481016(11914)2219(27)132820242317(25(20)2)1218(26)21156435715h311H1213H212H3(H2126)(H2227)
MFCD04154078
ZINC000000633865
ZINC00633865
ZINC633865
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