Vitas-M small molecule compound

(5E)-5-[3-methoxy-4-(propan-2-yloxy)benzylidene]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-thiazolidine-2,4-dione

Catalog ID
STL371508
SMILES COc1cc(ccc1OC(C)C)/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCN(CC1)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 C26H29N3O5S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O5S/c1-18(2)34-21-10-9-19(15-22(21)33-3)16-23-25(31)29(26(32)35-23)17-24(30)28-13-11-27(12-14-28)20-7-5-4-6-8-20/h4-10,15-16,18H,11-14,17H2,1-3H3/b23-16+
InChIKey
NTBSHYFMBBTGTQ-XQNSMLJCSA-N
Synonyms

(5E)5((3METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
(5E)5(3methoxy4(propan2yloxy)benzylidene)3(2oxo2(4phenylpiperazin1yl)ethyl)13thiazolidine24dione
5(4ISOPROPOXY3METHOXYBENZYLIDENE)3(2OXO2(4PHENYL1PIPERAZINYL)ETHYL)13THIAZOLIDINE24DIONE
CC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)OC
COc1cc(ccc1OC(C)C)C=C1SC(=O)N(C1=O)CC(=O)N1CCN(CC1)c1ccccc1
InChI=1SC26H29N3O5Sc118(2)342110919(1522(21)333)162325(31)29(26(32)3523)1724(30)28131127(121428)207546820h410151618H111417H213H3b2316+
MFCD03270017
ZINC000008396049
ZINC08396049
ZINC8396049

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Available files

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