Vitas-M small molecule compound
N-(4-chloro-2-nitrophenyl)-6-nitro-1,2-benzothiazol-3-amine 1,1-dioxide
Catalog ID
STK672748
SMILES Clc1ccc(c(c1)[N+](=O)[O-])NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]
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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 C13H7ClN4O6S MW 382.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7ClN4O6S/c14-7-1-4-10(11(5-7)18(21)22)15-13-9-3-2-8(17(19)20)6-12(9)25(23,24)16-13/h1-6H,(H,15,16)InChIKey
QMQDPKDZZNQQHL-UHFFFAOYSA-NSynonyms
C1=CC2=C(C=C1(N+)(=O)(O))S(=O)(=O)N=C2NC3=C(C=C(C=C3)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)(N+)(=O)(O))NC1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O)
InChI=1SC13H7ClN4O6Sc1471410(11(57)18(21)22)15139328(17(19)20)612(9)25(2324)1613h16H(H1516)
MFCD00486300
N(4CHLORO2NITROPHENYL)6NITRO11DIOXO12BENZOTHIAZOL3AMINE
N(4chloro2nitrophenyl)6nitro12benzothiazol3amine11dioxide
ZINC000012375207
ZINC12375207
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