Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK696960
SMILES C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1cccc(c1)OC
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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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-3-9-25-20(14-5-4-6-16(10-14)27-2)23-24-21(25)30-12-19(26)22-15-7-8-17-18(11-15)29-13-28-17/h3-8,10-11H,1,9,12-13H2,2H3,(H,22,26)InChIKey
PXRYDXBXMYQAEN-UHFFFAOYSA-NSynonyms
848991-73-12((4allyl5(3methoxyphenyl)4H124triazol3yl)thio)N(benzo(d)(13)dioxol5yl)acetamide
848991731
COC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC21H20N4O4Sc1392520(1454616(1014)272)232421(25)301219(26)2215781718(1115)29132817h381011H191213H22H3(H2226)
MFCD05679011
N(13benzodioxol5yl)2((5(3methoxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(13BENZODIOXOL5YL)2((5(3METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2H13BENZODIOXOL5YL)2((5(3METHOXYPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(5(3METHOXYPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002446823
ZINC02446823
ZINC2446823
Check stock
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Check stock on Vitas-MAvailable files
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