Vitas-M small molecule compound
4-(4-chloro-2-methylphenoxy)-N-{3-[(1E)-1-(2-{[2-(4-methoxyphenyl)quinolin-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}butanamide
Catalog ID
STK477003
SMILES COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)N/N=C(/c1cccc(c1)NC(=O)CCCOc1ccc(cc1C)Cl)\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 C36H33ClN4O4 MW 621.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H33ClN4O4/c1-23-20-27(37)15-18-34(23)45-19-7-12-35(42)38-28-9-6-8-26(21-28)24(2)40-41-36(43)31-22-33(25-13-16-29(44-3)17-14-25)39-32-11-5-4-10-30(31)32/h4-6,8-11,13-18,20-22H,7,12,19H2,1-3H3,(H,38,42)(H,41,43)/b40-24+InChIKey
KOYDWCOQCXRNPD-BKATUZMVSA-NSynonyms
4(4chloro2methylphenoxy)N(3((1E)1(2((2(4methoxyphenyl)quinolin4yl)carbonyl)hydrazinylidene)ethyl)phenyl)butanamide
CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=CC=CC(=C2)C(=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)C
COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NN=C(c1cccc(c1)NC(=O)CCCOc1ccc(cc1C)Cl)C
InChI=1SC36H33ClN4O4c1232027(37)151834(23)451971235(42)382896826(2128)24(2)404136(43)312233(25131629(443)171425)393211541030(31)32h4681113182022H71219H213H3(H3842)(H4143)b4024+
MFCD08097709
N((E)1(3(4(4chloro2methylphenoxy)butanoylamino)phenyl)ethylideneamino)2(4methoxyphenyl)quinoline4carboxamide
N(3((1E)2((2(4METHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)4(4CHLORO2METHYLPHENOXY)BUTANAMIDE
ZINC000097965857
ZINC102356165
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