Vitas-M small molecule compound
(5Z)-1-(4-methoxyphenyl)-5-[(morpholin-4-ylamino)methylidene]-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL006921
SMILES COc1ccc(cc1)N1C(=S)N(c2ccccc2)C(=O)/C(=C/NN2CCOCC2)/C1=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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-29-18-9-7-17(8-10-18)26-21(28)19(15-23-24-11-13-30-14-12-24)20(27)25(22(26)31)16-5-3-2-4-6-16/h2-10,15,23H,11-14H2,1H3/b19-15-InChIKey
PZGGTPCZEHIAFM-CYVLTUHYSA-NSynonyms
(5Z)1(4METHOXYPHENYL)5((MORPHOLIN4YLAMINO)METHYLIDENE)3PHENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4methoxyphenyl)5((morpholin4ylamino)methylidene)3phenyl2thioxodihydropyrimidine46(1H5H)dione
(Z)1(4methoxyphenyl)5((morpholinoamino)methylene)3phenyl2thioxodihydropyrimidine46(1H5H)dione
COC1=CC=C(C=C1)N2C(=O)C(=CNN3CCOCC3)C(=O)N(C2=S)C4=CC=CC=C4
COc1ccc(cc1)N1C(=S)N(c2ccccc2)C(=O)C(=CNN2CCOCC2)C1=O
InChI=1SC22H22N4O4Sc129189717(81018)2621(28)19(152324111330141224)20(27)25(22(26)31)165324616h2101523H1114H21H3b1915
MFCD05698420
ZINC000009292333
ZINC09292333
ZINC9292333
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