Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide
Catalog ID
STK246289
SMILES C=CCn1c(nnc1c1cc2c(o1)cccc2)SC(C(=O)Nc1nc(c(s1)C)C)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 C21H21N5O2S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S2/c1-5-10-26-18(17-11-15-8-6-7-9-16(15)28-17)24-25-21(26)30-14(4)19(27)23-20-22-12(2)13(3)29-20/h5-9,11,14H,1,10H2,2-4H3,(H,22,23,27)InChIKey
ZAPOLNZUDKAKKH-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(45dimethyl13thiazol2yl)propanamide
2((5(1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)N(45dimethyl13thiazol2yl)propanamide
2(4ALLYL5BENZOFURAN2YL4H(124)TRIAZOL3YLSULFANYL)N(45DIMETHYLTHIAZOL2YL)PROPIONAMIDE
CC1=C(SC(=N1)NC(=O)C(C)SC2=NN=C(N2CC=C)C3=CC4=CC=CC=C4O3)C
InChI=1SC21H21N5O2S2c15102618(171115867916(15)2817)242521(26)3014(4)19(27)23202212(2)13(3)2920h591114H110H224H3(H222327)
MFCD08683938
ZINC000009329109
ZINC000009329110
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