Vitas-M small molecule compound
ethyl (2Z)-5-[4-(methylsulfanyl)phenyl]-3-oxo-7-phenyl-2-{[1-(propan-2-yl)-1H-indol-3-yl]methylidene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK381142
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)SC)c(=O)/c(=C/c1cn(c3c1cccc3)C(C)C)/s2)c1ccccc1
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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 C34H31N3O3S2 MW 593.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N3O3S2/c1-5-40-33(39)29-30(22-11-7-6-8-12-22)35-34-37(31(29)23-15-17-25(41-4)18-16-23)32(38)28(42-34)19-24-20-36(21(2)3)27-14-10-9-13-26(24)27/h6-21,31H,5H2,1-4H3/b28-19-InChIKey
OJXCBZHTIDPHNX-USHMODERSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)SC)c(=O)c(=Cc1cn(c3c1cccc3)C(C)C)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)C(=CC4=CN(C5=CC=CC=C54)C(C)C)S2)C6=CC=CC=C6
ethyl(2Z)5(4(methylsulfanyl)phenyl)3oxo7phenyl2((1(propan2yl)1Hindol3yl)methylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4METHYLSULFANYLPHENYL)3OXO7PHENYL2((1PROPAN2YLINDOL3YL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((1(METHYLETHYL)INDOL3YL)METHYLENE)5(4METHYLTHIOPHENYL)3OXO7PHENYL45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC34H31N3O3S2c154033(39)2930(22117681222)353437(31(29)23151725(414)181623)32(38)28(4234)19242036(21(2)3)27141091326(24)27h62131H5H214H3b2819
MFCD02603594
ZINC000004090309
ZINC000004090312
Check stock
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Check stock on Vitas-MAvailable files
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