Vitas-M small molecule compound
(5Z)-5-{[3-(3-chloro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-[2-(4-methoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK816154
SMILES CCCOc1ccc(cc1Cl)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 C31H28ClN3O3S2 MW 590.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O3S2/c1-3-17-38-27-14-11-22(18-26(27)32)29-23(20-35(33-29)24-7-5-4-6-8-24)19-28-30(36)34(31(39)40-28)16-15-21-9-12-25(37-2)13-10-21/h4-14,18-20H,3,15-17H2,1-2H3/b28-19-InChIKey
ITTZJYGHGKKMSF-USHMODERSA-NSynonyms
(5Z)5((3(3chloro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(2(4methoxyphenyl)ethyl)2thioxo13thiazolidin4one
(5Z)5((3(3CHLORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)C5=CC=CC=C5)Cl
CCCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccc(cc1)OC)c1ccccc1
InChI=1SC31H28ClN3O3S2c13173827141122(1826(27)32)2923(2035(3329)247546824)192830(36)34(31(39)4028)16152191225(372)131021h4141820H31517H212H3b2819
MFCD06642692
ZINC000097946557
ZINC97946557
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