Vitas-M small molecule compound
(2E)-3-(3,5-dichloro-2-methoxyphenyl)-N-{4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}prop-2-enamide
Catalog ID
STK336901
SMILES COc1c(/C=C/C(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2cccs2)cc(cc1Cl)Cl
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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 C25H23Cl2N3O3S MW 516.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N3O3S/c1-33-24-17(15-18(26)16-21(24)27)4-9-23(31)28-19-5-7-20(8-6-19)29-10-12-30(13-11-29)25(32)22-3-2-14-34-22/h2-9,14-16H,10-13H2,1H3,(H,28,31)/b9-4+InChIKey
NFYBIVUDNSOJPF-RUDMXATFSA-NSynonyms
(2E)3(35dichloro2methoxyphenyl)N(4(4(thiophen2ylcarbonyl)piperazin1yl)phenyl)prop2enamide
(E)3(35DICHLORO2METHOXYPHENYL)N(4(4(THIOPHENE2CARBONYL)PIPERAZIN1YL)PHENYL)PROP2ENAMIDE
COC1=C(C=C(C=C1C=CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4)Cl)Cl
COc1c(C=CC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2cccs2)cc(cc1Cl)Cl
InChI=1SC25H23Cl2N3O3Sc1332417(1518(26)1621(24)27)4923(31)28195720(8619)29101230(131129)25(32)2232143422h291416H1013H21H3(H2831)b94+
MFCD04077209
ZINC000001114616
ZINC01114616
ZINC1114616
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