Vitas-M small molecule compound

3,4,6-trimethyl-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide

Catalog ID
STK516549
SMILES CCCSc1nnc(s1)NC(=O)c1oc2c(c1C)c(C)cc(c2)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 C17H19N3O2S2 MW 361.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O2S2/c1-5-6-23-17-20-19-16(24-17)18-15(21)14-11(4)13-10(3)7-9(2)8-12(13)22-14/h7-8H,5-6H2,1-4H3,(H,18,19,21)
InChIKey
MFHPFIWPQNYCSR-UHFFFAOYSA-N
Synonyms

346trimethylN(5(propylsulfanyl)134thiadiazol2yl)1benzofuran2carboxamide
346TRIMETHYLN(5PROPYLSULFANYL134THIADIAZOL2YL)1BENZOFURAN2CARBOXAMIDE
CCCSC1=NN=C(S1)NC(=O)C2=C(C3=C(C=C(C=C3O2)C)C)C
InChI=1SC17H19N3O2S2c1562317201916(2417)1815(21)1411(4)1310(3)79(2)812(13)2214h78H56H214H3(H181921)
MFCD05884468
ZINC000004671414
ZINC04671414
ZINC4671414

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.