Vitas-M small molecule compound
(5Z)-5-(2-ethoxybenzylidene)-3-(4-ethoxyphenyl)-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL378784
SMILES CCOc1ccc(cc1)N1C(=S)N(/C(=C\c2ccccc2OCC)/C1=O)C
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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 C21H22N2O3S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S/c1-4-25-17-12-10-16(11-13-17)23-20(24)18(22(3)21(23)27)14-15-8-6-7-9-19(15)26-5-2/h6-14H,4-5H2,1-3H3/b18-14-InChIKey
AENBBOPEGCYUDD-JXAWBTAJSA-NSynonyms
(5Z)3(4ETHOXYPHENYL)5((2ETHOXYPHENYL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(2ethoxybenzylidene)3(4ethoxyphenyl)1methyl2thioxoimidazolidin4one
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3OCC)N(C2=S)C
CCOc1ccc(cc1)N1C(=S)N(C(=Cc2ccccc2OCC)C1=O)C
InChI=1SC21H22N2O3Sc142517121016(111317)2320(24)18(22(3)21(23)27)1415867919(15)2652h614H45H213H3b1814
MFCD03715948
ZINC000002818750
ZINC02818750
ZINC2818750
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