Vitas-M small molecule compound
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butanamide
Catalog ID
STK506377
SMILES C=CCn1c(nnc1c1cccnc1)SC(C(=O)Nc1nnc(s1)CC)CC
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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 C18H21N7OS2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7OS2/c1-4-10-25-15(12-8-7-9-19-11-12)22-24-18(25)27-13(5-2)16(26)20-17-23-21-14(6-3)28-17/h4,7-9,11,13H,1,5-6,10H2,2-3H3,(H,20,23,26)InChIKey
HMEIGPPVTPKTES-UHFFFAOYSA-NSynonyms
CCC1=NN=C(S1)NC(=O)C(CC)SC2=NN=C(N2CC=C)C3=CN=CC=C3
InChI=1SC18H21N7OS2c14102515(12879191112)222418(25)2713(52)16(26)2017232114(63)2817h4791113H15610H223H3(H202326)
MFCD13368977
N(5ethyl134thiadiazol2yl)2((4(prop2en1yl)5(pyridin3yl)4H124triazol3yl)sulfanyl)butanamide
N(5ethyl134thiadiazol2yl)2((4prop2enyl5pyridin3yl124triazol3yl)sulfanyl)butanamide
ZINC000035655248
ZINC000035655250
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