Vitas-M small molecule compound
(5Z)-5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK906613
SMILES CCCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)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 C31H29N3O2S2 MW 539.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2S2/c1-3-4-18-36-27-17-11-14-24(19-27)29-25(21-33(32-29)26-15-9-6-10-16-26)20-28-30(35)34(31(37)38-28)22(2)23-12-7-5-8-13-23/h5-17,19-22H,3-4,18H2,1-2H3/b28-20-InChIKey
UBFYFMJDCLMNNL-RRAHZORUSA-NSynonyms
1010864-49-9(5Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(3BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
1010864499
CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)C5=CC=CC=C5
CCCCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1
InChI=1SC31H29N3O2S2c13418362717111424(1927)2925(2133(3229)261596101626)202830(35)34(31(37)3828)22(2)23127581323h5171922H3418H212H3b2820
MFCD05706040
ZINC000101253695
ZINC000101253697
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