Vitas-M small molecule compound

2-[5-(1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]-N-tert-butylacetamide

Catalog ID
STK393496
SMILES O=C(NC(C)(C)C)Cn1nnc(n1)c1ccc2c(c1)OCO2

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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 C14H17N5O3 MW 303.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N5O3/c1-14(2,3)15-12(20)7-19-17-13(16-18-19)9-4-5-10-11(6-9)22-8-21-10/h4-6H,7-8H2,1-3H3,(H,15,20)
InChIKey
DLTHHNMZTVGQOJ-UHFFFAOYSA-N
Synonyms

2(5(13benzodioxol5yl)2Htetrazol2yl)Ntertbutylacetamide
2(5(13BENZODIOXOL5YL)TETRAZOL2YL)NTERTBUTYLACETAMIDE
2(5BENZO(13)DIOXOL5YLTETRAZOL2YL)NTERTBUTYLACETAMIDE
CC(C)(C)NC(=O)CN1N=C(N=N1)C2=CC3=C(C=C2)OCO3
InChI=1SC14H17N5O3c114(23)1512(20)7191713(161819)9451011(69)2282110h46H78H213H3(H1520)
MFCD02232940
ZINC000000176892
ZINC00176892
ZINC176892

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Available files

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