Vitas-M small molecule compound

N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide

Catalog ID
STK433405
SMILES CCSc1nnc(s1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C

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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 C12H12N4O3S2 MW 324.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O3S2/c1-3-20-12-15-14-11(21-12)13-10(17)8-5-4-7(2)9(6-8)16(18)19/h4-6H,3H2,1-2H3,(H,13,14,17)
InChIKey
AJCOMCAVYUEJOQ-UHFFFAOYSA-N
Synonyms

CCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)C)(N+)(=O)(O)
CCSc1nnc(s1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC12H12N4O3S2c132012151411(2112)1310(17)8547(2)9(68)16(18)19h46H3H212H3(H131417)
MFCD00805228
N(5(ETHYLSULFANYL)134THIADIAZOL2YL)3NITRO4METHYLBENZAMIDE
N(5(ethylsulfanyl)134thiadiazol2yl)4methyl3nitrobenzamide
N(5ETHYLSULFANYL134THIADIAZOL2YL)4METHYL3NITROBENZAMIDE
N(5ETHYLTHIO(134THIADIAZOL2YL))(4METHYL3NITROPHENYL)CARBOXAMIDE
ZINC000002026124
ZINC02026124
ZINC2026124

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Available files

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