Vitas-M small molecule compound
4-chloro-3-nitro-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Catalog ID
STK601702
SMILES CCCS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccc(c(c2)[N+](=O)[O-])Cl)/s1
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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 C12H11ClN4O5S2 MW 390.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClN4O5S2/c1-2-5-24(21,22)12-16-15-11(23-12)14-10(18)7-3-4-8(13)9(6-7)17(19)20/h3-4,6H,2,5H2,1H3,(H,14,15,18)InChIKey
BZHCEKZZCCNYIC-UHFFFAOYSA-NSynonyms
895834-61-44chloro3nitroN((2Z)5(propylsulfonyl)134thiadiazol2(3H)ylidene)benzamide
4chloro3nitroN(5propylsulfonyl134thiadiazol2yl)benzamide
895834614
CCCS(=O)(=O)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)(N+)(=O)(O)
CCCS(=O)(=O)c1n(nH)c(=NC(=O)c2ccc(c(c2)(N+)(=O)(O))Cl)s1
InChI=1SC12H11ClN4O5S2c12524(2122)12161511(2312)1410(18)7348(13)9(67)17(19)20h346H25H21H3(H141518)
MFCD08732422
ZINC000013608794
ZINC13608794
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