Vitas-M small molecule compound
N-(4-{3-acetyl-1-(4-chlorophenyl)-5-[(E)-2-phenylethenyl]-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)-2-methylpropanamide
Catalog ID
STK513024
SMILES O=C(C(C)C)Nc1ccc(cc1)N1C(=NN(C1/C=C/c1ccccc1)c1ccc(cc1)Cl)C(=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 C28H27ClN4O2 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN4O2/c1-19(2)28(35)30-23-12-16-24(17-13-23)32-26(18-9-21-7-5-4-6-8-21)33(31-27(32)20(3)34)25-14-10-22(29)11-15-25/h4-19,26H,1-3H3,(H,30,35)/b18-9+InChIKey
BHBITXJLVUKZKY-GIJQJNRQSA-NSynonyms
CC(C)C(=O)NC1=CC=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=C(C=C3)Cl)C=CC4=CC=CC=C4
InChI=1SC28H27ClN4O2c119(2)28(35)3023121624(171323)3226(189217546821)33(3127(32)20(3)34)25141022(29)111525h41926H13H3(H3035)b189+
MFCD03863936
N(4(3acetyl1(4chlorophenyl)5((E)2phenylethenyl)15dihydro4H124triazol4yl)phenyl)2methylpropanamide
N(4(3ACETYL1(4CHLOROPHENYL)5(2PHENYLVINYL)15DIHYDRO4H124TRIAZOL4YL)PHENYL)2METHYLPROPANAMIDE
N(4(5ACETYL2(4CHLOROPHENYL)3((E)2PHENYLETHENYL)3H124TRIAZOL4YL)PHENYL)2METHYLPROPANAMIDE
O=C(C(C)C)Nc1ccc(cc1)N1C(=NN(C1C=Cc1ccccc1)c1ccc(cc1)Cl)C(=O)C
ZINC000002177847
ZINC000002177849
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