Vitas-M small molecule compound
N,N-dimethyl-8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine
Catalog ID
STL351311
SMILES CN(c1ncnc2c1N=Cc1c(S2)ccc(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 C13H11N5O2S MW 301.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5O2S/c1-17(2)12-11-13(16-7-15-12)21-10-4-3-9(18(19)20)5-8(10)6-14-11/h3-7H,1-2H3InChIKey
CKVQLJNMNIPAHP-UHFFFAOYSA-NSynonyms
89046-91-389046913
CN(C)C1=C2C(=NC=N1)SC3=C(C=C(C=C3)(N+)(=O)(O))C=N2
CN(c1ncnc2c1N=Cc1c(S2)ccc(c1)(N+)(=O)(O))C
InChI=1SC13H11N5O2Sc117(2)121113(1671512)2110439(18(19)20)58(10)61411h37H12H3
MFCD12200642
NNdimethyl8nitrobenzo(f)pyrimido(45b)(14)thiazepin4amine
NNdimethyl8nitropyrimido(45b)(14)benzothiazepin4amine
ZINC000012388832
ZINC12388832
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