Vitas-M small molecule compound
(5Z)-3-benzyl-5-(3-methoxy-4-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK087929
SMILES COc1cc(ccc1OCCOc1cc(C)ccc1C(C)C)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C30H31NO4S2 MW 533.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO4S2/c1-20(2)24-12-10-21(3)16-26(24)35-15-14-34-25-13-11-23(17-27(25)33-4)18-28-29(32)31(30(36)37-28)19-22-8-6-5-7-9-22/h5-13,16-18,20H,14-15,19H2,1-4H3/b28-18-InChIKey
JVKNVZKPJOBSPF-VEILYXNESA-NSynonyms
(5Z)3BENZYL5((3METHOXY4(2(5METHYL2PROPAN2YLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3BENZYL5(3METHOXY4(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)OC
COc1cc(ccc1OCCOc1cc(C)ccc1C(C)C)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC30H31NO4S2c120(2)24121021(3)1626(24)3515143425131123(1727(25)334)182829(32)31(30(36)3728)19228657922h513161820H141519H214H3b2818
MFCD02109286
STK087929
ZINC000100268780
ZINC100268780
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