Vitas-M small molecule compound
N-(3-acetylphenyl)-2-{[5-(3-chloro-4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK216114
SMILES C=CCn1c(SCC(=O)Nc2cccc(c2)C(=O)C)nnc1c1ccc(c(c1)Cl)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 C22H21ClN4O2S MW 440.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O2S/c1-4-10-27-21(17-9-8-14(2)19(23)12-17)25-26-22(27)30-13-20(29)24-18-7-5-6-16(11-18)15(3)28/h4-9,11-12H,1,10,13H2,2-3H3,(H,24,29)InChIKey
VKCMTLYZXSJEPJ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=CC(=C3)C(=O)C)Cl
InChI=1SC22H21ClN4O2Sc14102721(179814(2)19(23)1217)252622(27)301320(29)241875616(1118)15(3)28h491112H11013H223H3(H2429)
MFCD04387341
N(3ACETYLPHENYL)2((5(3CHLORO4METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3acetylphenyl)2((5(3chloro4methylphenyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000010059446
ZINC10059446
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