Vitas-M small molecule compound
1-(5-{5-chloro-2-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-4-[4-(pyrrolidin-1-yl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethanone
Catalog ID
STK513030
SMILES Clc1ccc(c(c1)C1N(N=C(N1c1ccc(cc1)N1CCCC1)C(=O)C)c1ccccc1)OCc1ccccc1Cl
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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 C33H30Cl2N4O2 MW 585.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30Cl2N4O2/c1-23(40)32-36-39(28-10-3-2-4-11-28)33(38(32)27-16-14-26(15-17-27)37-19-7-8-20-37)29-21-25(34)13-18-31(29)41-22-24-9-5-6-12-30(24)35/h2-6,9-18,21,33H,7-8,19-20,22H2,1H3InChIKey
ZFRPJFKYSRUFNB-UHFFFAOYSA-NSynonyms
1(3(5CHLORO2((2CHLOROPHENYL)METHOXY)PHENYL)2PHENYL4(4PYRROLIDIN1YLPHENYL)3H124TRIAZOL5YL)ETHANONE
1(5(5CHLORO2((2CHLOROBENZYL)OXY)PHENYL)1PHENYL4(4(1PYRROLIDINYL)PHENYL)45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1(5(5chloro2((2chlorobenzyl)oxy)phenyl)1phenyl4(4(pyrrolidin1yl)phenyl)45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)N3CCCC3)C4=C(C=CC(=C4)Cl)OCC5=CC=CC=C5Cl)C6=CC=CC=C6
InChI=1SC33H30Cl2N4O2c123(40)323639(28103241128)33(38(32)27161426(151727)3719782037)292125(34)131831(29)4122249561230(24)35h269182133H78192022H21H3
MFCD03863951
ZINC000005943809
ZINC000005943839
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