Vitas-M small molecule compound

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

Catalog ID
STK462573
SMILES O=C(c1ccccc1[N+](=O)[O-])Nc1nnc(s1)C1CC1

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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 C12H10N4O3S MW 290.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O3S/c17-10(8-3-1-2-4-9(8)16(18)19)13-12-15-14-11(20-12)7-5-6-7/h1-4,7H,5-6H2,(H,13,15,17)
InChIKey
INCBFVBCJUVLMF-UHFFFAOYSA-N
Synonyms

C1CC1C2=NN=C(S2)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC12H10N4O3Sc1710(831249(8)16(18)19)1312151411(2012)7567h147H56H2(H131517)
MFCD06004263
N(5CYCLOPROPYL(134THIADIAZOL2YL))(2NITROPHENYL)CARBOXAMIDE
N(5cyclopropyl134thiadiazol2yl)2nitrobenzamide
O=C(c1ccccc1(N+)(=O)(O))Nc1nnc(s1)C1CC1
ZINC000001053785
ZINC01053785
ZINC1053785

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Available files

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