Vitas-M small molecule compound
(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL054645
SMILES Clc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S
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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 C24H17ClF3N3O2S MW 503.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClF3N3O2S/c1-13-10-15(14(2)30(13)18-8-6-17(25)7-9-18)11-20-21(32)29-23(34)31(22(20)33)19-5-3-4-16(12-19)24(26,27)28/h3-12H,1-2H3,(H,29,32,34)/b20-11-InChIKey
WBBUNSPTKLUWPN-JAIQZWGSSA-NSynonyms
716334-45-1(5Z)5((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)2sulfanyl1(3(trifluoromethyl)phenyl)pyrimidine46(1H5H)dione
(5Z)5((1(4CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINANE46DIONE
716334451
CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C(F)(F)F
Clc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S
InChI=1SC24H17ClF3N3O2Sc1131015(14(2)30(13)188617(25)7918)112021(32)2923(34)31(22(20)33)1953416(1219)24(2627)28h312H12H3(H293234)b2011
MFCD05738373
ZINC000001279398
ZINC01279398
ZINC09466055
ZINC1279398
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