Vitas-M small molecule compound
(2E)-3-(5-bromo-2-methoxyphenyl)-N-{[2-(morpholin-4-yl)phenyl]carbamothioyl}prop-2-enamide
Catalog ID
STK864045
SMILES COc1ccc(cc1/C=C/C(=O)NC(=S)Nc1ccccc1N1CCOCC1)Br
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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 C21H22BrN3O3S MW 476.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O3S/c1-27-19-8-7-16(22)14-15(19)6-9-20(26)24-21(29)23-17-4-2-3-5-18(17)25-10-12-28-13-11-25/h2-9,14H,10-13H2,1H3,(H2,23,24,26,29)/b9-6+InChIKey
QZXCRWFNKSUWGQ-RMKNXTFCSA-NSynonyms
527713-96-8(2E)3(5bromo2methoxyphenyl)N((2(morpholin4yl)phenyl)carbamothioyl)prop2enamide
(E)3(5BROMO2METHOXYPHENYL)N((2MORPHOLIN4YLPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(5bromo2methoxyphenyl)N((2morpholinophenyl)carbamothioyl)acrylamide
527713968
COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3
COc1ccc(cc1C=CC(=O)NC(=S)Nc1ccccc1N1CCOCC1)Br
InChI=1SC21H22BrN3O3Sc127198716(22)1415(19)6920(26)2421(29)2317423518(17)25101228131125h2914H1013H21H3(H223242629)b96+
MFCD03553910
ZINC000001114819
ZINC01114819
ZINC1114819
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