Vitas-M small molecule compound
(2E)-3-(4-bromophenyl)-N-{[2-(pyridin-3-yl)piperidin-1-yl]carbamothioyl}prop-2-enamide
Catalog ID
STK550176
SMILES S=C(NN1CCCCC1c1cccnc1)NC(=O)/C=C/c1ccc(cc1)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 C20H21BrN4OS MW 445.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4OS/c21-17-9-6-15(7-10-17)8-11-19(26)23-20(27)24-25-13-2-1-5-18(25)16-4-3-12-22-14-16/h3-4,6-12,14,18H,1-2,5,13H2,(H2,23,24,26,27)/b11-8+InChIKey
JKECHXGOXFKXMC-DHZHZOJOSA-NSynonyms
799828-33-4(2E)3(4bromophenyl)N((2(pyridin3yl)piperidin1yl)carbamothioyl)prop2enamide
(E)3(4bromophenyl)N((2(pyridin3yl)piperidin1yl)carbamothioyl)acrylamide
(E)3(4BROMOPHENYL)N((2PYRIDIN3YLPIPERIDIN1YL)CARBAMOTHIOYL)PROP2ENAMIDE
799828334
C1CCN(C(C1)C2=CN=CC=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)Br
InChI=1SC20H21BrN4OSc21179615(71017)81119(26)2320(27)24251321518(25)164312221416h346121418H12513H2(H223242627)b118+
MFCD03683675
S=C(NN1CCCCC1c1cccnc1)NC(=O)C=Cc1ccc(cc1)Br
ZINC000009478035
ZINC000009478036
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