Vitas-M small molecule compound

N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide

Catalog ID
STK176268
SMILES CCCCc1nnc(s1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC

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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 C14H16N4O4S MW 336.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O4S/c1-3-4-5-12-16-17-14(23-12)15-13(19)9-6-7-11(22-2)10(8-9)18(20)21/h6-8H,3-5H2,1-2H3,(H,15,17,19)
InChIKey
RPLJRNLVSYVTDE-UHFFFAOYSA-N
Synonyms
768292-67-7
768292677
CCCCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O)
CCCCc1nnc(s1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC14H16N4O4Sc134512161714(2312)1513(19)96711(222)10(89)18(20)21h68H35H212H3(H151719)
MFCD06006724
N(5BUTYL(134THIADIAZOL2YL))(4METHOXY3NITROPHENYL)CARBOXAMIDE
N(5BUTYL134THIADIAZOL2YL)4METHOXY3NITROBENZAMIDE
ZINC000002878148
ZINC02878148
ZINC2878148

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Available files

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