Vitas-M small molecule compound
1-(biphenyl-4-yl)-2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STL026136
SMILES COc1ccc(cc1)c1nnc(n1CC=C)SCC(=O)c1ccc(cc1)c1ccccc1
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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 C26H23N3O2S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O2S/c1-3-17-29-25(22-13-15-23(31-2)16-14-22)27-28-26(29)32-18-24(30)21-11-9-20(10-12-21)19-7-5-4-6-8-19/h3-16H,1,17-18H2,2H3InChIKey
PADPHGZSVFVSFF-UHFFFAOYSA-NSynonyms
849034-05-51((11biphenyl)4yl)2((4allyl5(4methoxyphenyl)4H124triazol3yl)thio)ethanone
1(biphenyl4yl)2((5(4methoxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)ethanone
2((5(4METHOXYPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHAN1ONE
2((5(4METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHANONE
2(5(4METHOXYPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))1(4PHENYLPHENYL)ETHAN1ONE
849034055
COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC26H23N3O2Sc13172925(22131523(312)161422)272826(29)321824(30)2111920(101221)197546819h316H11718H22H3
MFCD05682211
ZINC000009307143
ZINC09307143
ZINC9307143
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