Vitas-M small molecule compound
(5Z)-1-(4-ethoxyphenyl)-5-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191648
SMILES C=CCOc1ccc(cc1OC)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)OCC
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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 C23H22N2O5S MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5S/c1-4-12-30-19-11-6-15(14-20(19)28-3)13-18-21(26)24-23(31)25(22(18)27)16-7-9-17(10-8-16)29-5-2/h4,6-11,13-14H,1,5,12H2,2-3H3,(H,24,26,31)/b18-13-InChIKey
IEPMRFRDVLYORO-AQTBWJFISA-NSynonyms
(5Z)1(4ETHOXYPHENYL)5((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4ETHOXYPHENYL)5(3METHOXY4(PROP2EN1YLOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCOc1ccc(cc1OC)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC=C)OC)C(=O)NC2=S
InChI=1SC23H22N2O5Sc1412301911615(1420(19)283)131821(26)2423(31)25(22(18)27)167917(10816)2952h46111314H1512H223H3(H242631)b1813
MFCD02628783
ZINC000006508334
ZINC06508334
ZINC6508334
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