Vitas-M small molecule compound
4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]benzonitrile
Catalog ID
STL428339
SMILES N#Cc1ccc(cc1)C=C1C(=O)NC(=O)NC1=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 C12H7N3O3 MW 241.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H7N3O3/c13-6-8-3-1-7(2-4-8)5-9-10(16)14-12(18)15-11(9)17/h1-5H,(H2,14,15,16,17,18)InChIKey
CBVJTZOGNARWMM-UHFFFAOYSA-NSynonyms
57270-79-84((246TRIOXO13DIAZINAN5YLIDENE)METHYL)BENZONITRILE
4((246TRIOXO13DIHYDROPYRIMIDIN5YLIDENE)METHYL)BENZENECARBONITRILE
4((246TRIOXOHEXAHYDROPYRIMIDIN5YLIDENE)METHYL)BENZONITRILE
4((246TRIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)BENZONITRILE
4((246trioxotetrahydropyrimidin5(2H)ylidene)methyl)benzonitrile
57270798
BENZONITRILE4((TETRAHYDRO246TRIOXO5(2H)PYRIMIDINYLIDENE)METHYL)
C1=CC(=CC=C1C=C2C(=O)NC(=O)NC2=O)C#N
InChI=1SC12H7N3O3c1368317(248)5910(16)1412(18)1511(9)17h15H(H21415161718)
MFCD00297600
ZINC000001624799
ZINC01624799
ZINC1624799
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