Vitas-M small molecule compound

2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide

Catalog ID
STK293321
SMILES CCCc1nnc(s1)NC(=O)C(n1nnc2c(c1=O)cccc2)CC

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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 C16H18N6O2S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O2S/c1-3-7-13-19-20-16(25-13)17-14(23)12(4-2)22-15(24)10-8-5-6-9-11(10)18-21-22/h5-6,8-9,12H,3-4,7H2,1-2H3,(H,17,20,23)
InChIKey
FPLRZXHNFWAOPY-UHFFFAOYSA-N
Synonyms

2(4oxo123benzotriazin3(4H)yl)N(5propyl134thiadiazol2yl)butanamide
2(4oxo123benzotriazin3yl)N(5propyl134thiadiazol2yl)butanamide
CCCC1=NN=C(S1)NC(=O)C(CC)N2C(=O)C3=CC=CC=C3N=N2
InChI=1SC16H18N6O2Sc13713192016(2513)1714(23)12(42)2215(24)10856911(10)182122h568912H347H212H3(H172023)
MFCD09960526
ZINC000009025719
ZINC000009025721

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Available files

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