Vitas-M small molecule compound
(5Z)-3-[2-(4-methoxyphenyl)ethyl]-5-{[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK810736
SMILES CCCOc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccc(cc1)OC)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 C32H31N3O3S2 MW 569.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O3S2/c1-4-18-38-27-14-15-28(22(2)19-27)30-24(21-35(33-30)25-8-6-5-7-9-25)20-29-31(36)34(32(39)40-29)17-16-23-10-12-26(37-3)13-11-23/h5-15,19-21H,4,16-18H2,1-3H3/b29-20-InChIKey
OTADIDICMSJQAD-BRPDVVIDSA-NSynonyms
(5Z)3(2(4methoxyphenyl)ethyl)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(2(4METHOXYPHENYL)ETHYL)5((3(2METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)C5=CC=CC=C5)C
CCCOc1ccc(c(c1)C)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccc(cc1)OC)c1ccccc1
InChI=1SC32H31N3O3S2c14183827141528(22(2)1927)3024(2135(3330)258657925)202931(36)34(32(39)4029)171623101226(373)131123h5151921H41618H213H3b2920
MFCD04585859
ZINC000097946337
ZINC97946337
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