Vitas-M small molecule compound
N-[(5-{[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
Catalog ID
STK245862
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC)CNC(=O)c1cccc(c1)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 C22H21N5O2S MW 419.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O2S/c1-3-27-20(13-24-21(29)18-6-4-5-15(2)11-18)25-26-22(27)30-14-19(28)17-9-7-16(12-23)8-10-17/h4-11H,3,13-14H2,1-2H3,(H,24,29)InChIKey
MVTTVSWSMLWENT-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)CNC(=O)C3=CC(=CC=C3)C
InChI=1SC22H21N5O2Sc132720(132421(29)1864515(2)1118)252622(27)301419(28)179716(1223)81017h411H31314H212H3(H2429)
MFCD08670618
N((5((2(4CYANOPHENYL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N((5(2(4cyanophenyl)2oxoethyl)sulfanyl4ethyl124triazol3yl)methyl)3methylbenzamide
N(5(2(4CYANOPHENYL)2OXOETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YLMETHYL)3METHYLBENZAMIDE
ZINC000009328318
ZINC09328318
ZINC9328318
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