Vitas-M small molecule compound
2-[4-ethyl-5-({2-[(4-methoxybenzyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-N-(4-methylphenyl)acetamide
Catalog ID
STK297736
SMILES COc1ccc(cc1)CNC(=O)CSc1nnc(n1CC)CC(=O)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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-4-28-20(13-21(29)25-18-9-5-16(2)6-10-18)26-27-23(28)32-15-22(30)24-14-17-7-11-19(31-3)12-8-17/h5-12H,4,13-15H2,1-3H3,(H,24,30)(H,25,29)InChIKey
KAAYPETWQPXRPF-UHFFFAOYSA-NSynonyms
2(4ethyl5((2((4methoxybenzyl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)N(4methylphenyl)acetamide
2(4ETHYL5((4METHOXYBENZYLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)NPTOLYLACETAMIDE
2(4ethyl5(2((4methoxyphenyl)methylamino)2oxoethyl)sulfanyl124triazol3yl)N(4methylphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NCC2=CC=C(C=C2)OC)CC(=O)NC3=CC=C(C=C3)C
InChI=1SC23H27N5O3Sc142820(1321(29)25189516(2)61018)262723(28)321522(30)24141771119(313)12817h512H41315H213H3(H2430)(H2529)
MFCD09961130
ZINC000013956609
ZINC13956609
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