Vitas-M small molecule compound
(2E)-N-[(5-tert-butyl-3-chloro-2-hydroxyphenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STK106423
SMILES COc1ccc(cc1)/C=C/C(=O)NC(=S)Nc1cc(cc(c1O)Cl)C(C)(C)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 C21H23ClN2O3S MW 418.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN2O3S/c1-21(2,3)14-11-16(22)19(26)17(12-14)23-20(28)24-18(25)10-7-13-5-8-15(27-4)9-6-13/h5-12,26H,1-4H3,(H2,23,24,25,28)/b10-7+InChIKey
NQXXMHIWCGPWTG-JXMROGBWSA-NSynonyms
(2E)N((5TERTBUTYL3CHLORO2HYDROXYPHENYL)CARBAMOTHIOYL)3(4METHOXYPHENYL)PROP2ENAMIDE
(E)N((5TERTBUTYL3CHLORO2HYDROXYPHENYL)CARBAMOTHIOYL)3(4METHOXYPHENYL)PROP2ENAMIDE
CC(C)(C)C1=CC(=C(C(=C1)Cl)O)NC(=S)NC(=O)C=CC2=CC=C(C=C2)OC
COc1ccc(cc1)C=CC(=O)NC(=S)Nc1cc(cc(c1O)Cl)C(C)(C)C
InChI=1SC21H23ClN2O3Sc121(23)141116(22)19(26)17(1214)2320(28)2418(25)107135815(274)9613h51226H14H3(H223242528)b107+
MFCD03057876
ZINC000004680107
ZINC04680107
ZINC4680107
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