Vitas-M small molecule compound
N-[(4-ethyl-5-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-3,4-dimethoxybenzamide
Catalog ID
STK116586
SMILES COc1cc(ccc1OC)C(=O)NCc1nnc(n1CC)SCC(=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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-4-27-19(13-23-21(29)15-10-11-17(30-2)18(12-15)31-3)25-26-22(27)32-14-20(28)24-16-8-6-5-7-9-16/h5-12H,4,13-14H2,1-3H3,(H,23,29)(H,24,28)InChIKey
WOCDXMRAIAODEQ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC22H25N5O4Sc142719(132321(29)15101117(302)18(1215)313)252622(27)321420(28)24168657916h512H41314H213H3(H2329)(H2428)
MFCD04128145
N((4ETHYL5((2OXO2(PHENYLAMINO)ETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5((2ANILINO2OXOETHYL)THIO)4ETHYL4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5(2ANILINO2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
ZINC000001127676
ZINC01127676
ZINC1127676
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