Vitas-M small molecule compound
2-{[5-(1,3-benzodioxol-5-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
Catalog ID
STK337425
SMILES C=CCn1c(nnc1c1ccc2c(c1)OCO2)SC(C(=O)Nc1nnc(s1)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 C18H18N6O3S2 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O3S2/c1-4-7-24-15(12-5-6-13-14(8-12)27-9-26-13)21-23-18(24)28-10(2)16(25)19-17-22-20-11(3)29-17/h4-6,8,10H,1,7,9H2,2-3H3,(H,19,22,25)InChIKey
ZVOXZBSQIIRLGY-UHFFFAOYSA-NSynonyms
2((5(13benzodioxol5yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(5methyl134thiadiazol2yl)propanamide
2((5(13BENZODIOXOL5YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(5METHYL134THIADIAZOL2YL)PROPANAMIDE
2(4ALLYL5BENZO(13)DIOXOL5YL4H(124)TRIAZOL3YLSULFANYL)N(5METHYL(134)THIADIAZOL2YL)PROPIONAMIDE
CC1=NN=C(S1)NC(=O)C(C)SC2=NN=C(N2CC=C)C3=CC4=C(C=C3)OCO4
InChI=1SC18H18N6O3S2c1472415(12561314(812)2792613)212318(24)2810(2)16(25)1917222011(3)2917h46810H179H223H3(H192225)
MFCD07792592
ZINC000012843485
ZINC000012843487
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