Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK696696
SMILES C=CCn1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1cccc(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 C21H21ClN4OS MW 412.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4OS/c1-4-11-26-20(16-8-5-7-14(2)12-16)24-25-21(26)28-13-19(27)23-18-10-6-9-17(22)15(18)3/h4-10,12H,1,11,13H2,2-3H3,(H,23,27)InChIKey
OIZXKMGSRQTLEX-UHFFFAOYSA-NSynonyms
849002-20-62((4allyl5(mtolyl)4H124triazol3yl)thio)N(3chloro2methylphenyl)acetamide
849002206
CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=C(C(=CC=C3)Cl)C
InChI=1SC21H21ClN4OSc14112620(1685714(2)1216)242521(26)281319(27)2318106917(22)15(18)3h41012H11113H223H3(H2327)
MFCD04337596
N(3chloro2methylphenyl)2((5(3methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(3CHLORO2METHYLPHENYL)2((5(3METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO2METHYLPHENYL)2(5(3METHYLPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002450223
ZINC02450223
ZINC2450223
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