Vitas-M small molecule compound
(5Z)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-({3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702998
SMILES CC(Oc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1)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 C34H31N5O3S2 MW 621.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N5O3S2/c1-21(2)42-28-17-16-24(18-22(28)3)30-25(20-37(35-30)26-12-8-6-9-13-26)19-29-32(40)38(34(43)44-29)31-23(4)36(5)39(33(31)41)27-14-10-7-11-15-27/h6-21H,1-5H3/b29-19-InChIKey
RDCBDYZCUQMJTH-CEUNXORHSA-NSynonyms
(5Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5((3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)5((3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5((3(4isopropoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
CC(Oc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1)C
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C)C6=CC=CC=C6)OC(C)C
InChI=1SC34H31N5O3S2c121(2)4228171624(1822(28)3)3025(2037(3530)26128691326)192932(40)38(34(43)4429)3123(4)36(5)39(33(31)41)2714107111527h621H15H3b2919
MFCD02990236
ZINC000029492760
ZINC29492760
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