Vitas-M small molecule compound
2-{[1-(3-acetylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Catalog ID
STK777105
SMILES COc1cc(CCNC(=O)CSc2nnnn2c2cccc(c2)C(=O)C)ccc1OC
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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 C21H23N5O4S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4S/c1-14(27)16-5-4-6-17(12-16)26-21(23-24-25-26)31-13-20(28)22-10-9-15-7-8-18(29-2)19(11-15)30-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,22,28)InChIKey
ZPVYRRUJGLMBQR-UHFFFAOYSA-NSynonyms
2((1(3acetylphenyl)1Htetrazol5yl)sulfanyl)N(2(34dimethoxyphenyl)ethyl)acetamide
2(1(3ACETYLPHENYL)TETRAZOL5YL)SULFANYLN(2(34DIMETHOXYPHENYL)ETHYL)ACETAMIDE
CC(=O)C1=CC(=CC=C1)N2C(=NN=N2)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC
InChI=1SC21H23N5O4Sc114(27)1654617(1216)2621(23242526)311320(28)22109157818(292)19(1115)303h481112H91013H213H3(H2228)
MFCD05259981
ZINC000001424477
ZINC01424477
ZINC1424477
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