Vitas-M small molecule compound

5-chloro-2-(methylsulfonyl)-N-(3-nitrophenyl)pyrimidine-4-carboxamide

Catalog ID
STK909972
SMILES O=C(c1nc(ncc1Cl)S(=O)(=O)C)Nc1cccc(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 C12H9ClN4O5S MW 356.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9ClN4O5S/c1-23(21,22)12-14-6-9(13)10(16-12)11(18)15-7-3-2-4-8(5-7)17(19)20/h2-6H,1H3,(H,15,18)
InChIKey
SBSLCVTYRXKTPF-UHFFFAOYSA-N
Synonyms

5chloro2(methylsulfonyl)N(3nitrophenyl)pyrimidine4carboxamide
5CHLORO2METHANESULFONYLN(3NITROPHENYL)PYRIMIDINE4CARBOXAMIDE
5chloro2methylsulfonylN(3nitrophenyl)pyrimidine4carboxamide
CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC(=CC=C2)(N+)(=O)(O))Cl
InChI=1SC12H9ClN4O5Sc123(2122)121469(13)10(1612)11(18)1573248(57)17(19)20h26H1H3(H1518)
MFCD02673864
O=C(c1nc(ncc1Cl)S(=O)(=O)C)Nc1cccc(c1)(N+)(=O)(O)
ZINC000008868376
ZINC08868376
ZINC8868376

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Available files

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