Vitas-M small molecule compound
N-methyl-8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine
Catalog ID
STL351372
SMILES CNc1ncnc2c1N=Cc1c(S2)ccc(c1)[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 C12H9N5O2S MW 287.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N5O2S/c1-13-11-10-12(16-6-15-11)20-9-3-2-8(17(18)19)4-7(9)5-14-10/h2-6H,1H3,(H,13,15,16)InChIKey
AWJNRYHVCSGEOL-UHFFFAOYSA-NSynonyms
89046-90-289046902
CNC1=C2C(=NC=N1)SC3=C(C=C(C=C3)(N+)(=O)(O))C=N2
CNc1ncnc2c1N=Cc1c(S2)ccc(c1)(N+)(=O)(O)
InChI=1SC12H9N5O2Sc113111012(1661511)209328(17(18)19)47(9)51410h26H1H3(H131516)
MFCD12204555
Nmethyl8nitrobenzo(f)pyrimido(45b)(14)thiazepin4amine
Nmethyl8nitropyrimido(45b)(14)benzothiazepin4amine
ZINC000012409202
ZINC12409202
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