Vitas-M small molecule compound
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL019319
SMILES CCc1nnc(s1)NC(=O)c1ccc2c(c1)OCCCO2
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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 C14H15N3O3S MW 305.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O3S/c1-2-12-16-17-14(21-12)15-13(18)9-4-5-10-11(8-9)20-7-3-6-19-10/h4-5,8H,2-3,6-7H2,1H3,(H,15,17,18)InChIKey
ADXJRVLLIAIJCH-UHFFFAOYSA-NSynonyms
2H3H4HBENZO(B)14DIOXEPIN7YLN(5ETHYL(134THIADIAZOL2YL))CARBOXAMIDE
CCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)OCCCO3
InChI=1SC14H15N3O3Sc1212161714(2112)1513(18)9451011(89)207361910h458H2367H21H3(H151718)
MFCD07429092
N(5ethyl134thiadiazol2yl)34dihydro2H15benzodioxepine7carboxamide
ZINC000009477584
ZINC09477584
ZINC9477584
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