Vitas-M small molecule compound
5-[2-phenyl-1-(2-phenylethyl)-5,6,7,8-tetrahydroquinolin-4(1H)-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL073178
SMILES S=C1NC(=O)C(=c2cc(c3ccccc3)n(c3c2CCCC3)CCc2ccccc2)C(=O)N1
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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 C27H25N3O2S MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2S/c31-25-24(26(32)29-27(33)28-25)21-17-23(19-11-5-2-6-12-19)30(22-14-8-7-13-20(21)22)16-15-18-9-3-1-4-10-18/h1-6,9-12,17H,7-8,13-16H2,(H2,28,29,31,32,33)InChIKey
MXCJFYCOVVZZKW-UHFFFAOYSA-NSynonyms
865591-19-15(2phenyl1(2phenylethyl)5678tetrahydroquinolin4(1H)ylidene)2thioxodihydropyrimidine46(1H5H)dione
5(2phenyl1(2phenylethyl)5678tetrahydroquinolin4ylidene)2sulfanylidene13diazinane46dione
865591191
C1CCC2=C(C1)C(=C3C(=O)NC(=S)NC3=O)C=C(N2CCC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC27H25N3O2Sc312524(26(32)2927(33)2825)211723(19115261219)30(2214871320(21)22)16151893141018h1691217H781316H2(H22829313233)
MFCD04440869
ZINC000002692974
ZINC02692974
ZINC2692974
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