Vitas-M small molecule compound
(5Z)-3-(4-methoxybenzyl)-5-{[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK811251
SMILES CCCOc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccc(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 C31H29N3O3S2 MW 555.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S2/c1-4-16-37-26-14-15-27(21(2)17-26)29-23(20-34(32-29)24-8-6-5-7-9-24)18-28-30(35)33(31(38)39-28)19-22-10-12-25(36-3)13-11-22/h5-15,17-18,20H,4,16,19H2,1-3H3/b28-18-InChIKey
HKLVWQNDOCUHIJ-VEILYXNESA-NSynonyms
(5Z)3((4METHOXYPHENYL)METHYL)5((3(2METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4methoxybenzyl)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC)C5=CC=CC=C5)C
CCCOc1ccc(c(c1)C)c1nn(cc1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)OC)c1ccccc1
InChI=1SC31H29N3O3S2c14163726141527(21(2)1726)2923(2034(3229)248657924)182830(35)33(31(38)3928)1922101225(363)131122h515171820H41619H213H3b2818
MFCD06264840
ZINC000097946433
ZINC97946433
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