Vitas-M small molecule compound
5-(1-benzyl-2-phenyl-5,6,7,8-tetrahydroquinolin-4(1H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL073153
SMILES O=C1N(C)C(=O)C(=c2cc(c3ccccc3)n(c3c2CCCC3)Cc2ccccc2)C(=O)N1C
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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 C28H27N3O3 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3/c1-29-26(32)25(27(33)30(2)28(29)34)22-17-24(20-13-7-4-8-14-20)31(18-19-11-5-3-6-12-19)23-16-10-9-15-21(22)23/h3-8,11-14,17H,9-10,15-16,18H2,1-2H3InChIKey
PFXSECOKPZYZAY-UHFFFAOYSA-NSynonyms
5(1benzyl2phenyl5678tetrahydroquinolin4(1H)ylidene)13dimethylpyrimidine246(1H3H5H)trione
5(1benzyl2phenyl5678tetrahydroquinolin4ylidene)13dimethyl13diazinane246trione
CN1C(=O)C(=C2C=C(N(C3=C2CCCC3)CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)N(C1=O)C
InChI=1SC28H27N3O3c12926(32)25(27(33)30(2)28(29)34)221724(20137481420)31(1819115361219)23161091521(22)23h38111417H910151618H212H3
MFCD05744325
ZINC000000950195
ZINC00950195
ZINC950195
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