Vitas-M small molecule compound
N-[4-imino-7-(methylsulfanyl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Catalog ID
STL397905
SMILES CSc1ncc2c(n1)ncn(c2=N)NC(=O)c1ccc(o1)Cn1ncc(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 C16H13N9O4S MW 427.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N9O4S/c1-30-16-18-5-11-13(17)24(8-19-14(11)21-16)22-15(26)12-3-2-10(29-12)7-23-6-9(4-20-23)25(27)28/h2-6,8,17H,7H2,1H3,(H,22,26)/b17-13+InChIKey
GTJKBCOMMNIIIL-GHRIWEEISA-NSynonyms
1005577-95-61005577956
CSc1ncc2c(n1)ncn(c2=N)NC(=O)c1ccc(o1)Cn1ncc(c1)(N+)(=O)(O)
MFCD05667399
N(4imino7(methylsulfanyl)pyrimido(45d)pyrimidin3(4H)yl)5((4nitro1Hpyrazol1yl)methyl)furan2carboxamide
ZINC000004448296
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