Vitas-M small molecule compound
4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
Catalog ID
STK807437
SMILES CSc1nnc(s1)NC(=O)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3
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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 C19H16N4O3S2 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O3S2/c1-27-19-22-21-18(28-19)20-14(24)9-4-10-23-16(25)12-7-2-5-11-6-3-8-13(15(11)12)17(23)26/h2-3,5-8H,4,9-10H2,1H3,(H,20,21,24)InChIKey
NEFGJVOOWWJBNG-UHFFFAOYSA-NSynonyms
4(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)N(5(methylsulfanyl)134thiadiazol2yl)butanamide
4(13DIOXOBENZO(DE)ISOQUINOLIN2YL)N(5METHYLSULFANYL134THIADIAZOL2YL)BUTANAMIDE
CSC1=NN=C(S1)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
InChI=1SC19H16N4O3S2c12719222118(2819)2014(24)94102316(25)127251163813(15(11)12)17(23)26h2358H4910H21H3(H202124)
MFCD04444537
ZINC000004306807
ZINC04306807
ZINC4306807
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