Vitas-M small molecule compound
(5Z)-5-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-3-benzyl-1,3-thiazolidine-2,4-dione
Catalog ID
STK117464
SMILES O=C1S/C(=C\c2cn(c3c2cccc3)CC(=O)N2CCCCCC2)/C(=O)N1Cc1ccccc1
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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 C27H27N3O3S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S/c31-25(28-14-8-1-2-9-15-28)19-29-18-21(22-12-6-7-13-23(22)29)16-24-26(32)30(27(33)34-24)17-20-10-4-3-5-11-20/h3-7,10-13,16,18H,1-2,8-9,14-15,17,19H2/b24-16-InChIKey
MBAWZDPUGCDKMV-JLPGSUDCSA-NSynonyms
(5Z)5((1(2(AZEPAN1YL)2OXOETHYL)1HINDOL3YL)METHYLIDENE)3BENZYL13THIAZOLIDINE24DIONE
(5Z)5((1(2(AZEPAN1YL)2OXOETHYL)INDOL3YL)METHYLIDENE)3BENZYL13THIAZOLIDINE24DIONE
C1CCCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=O)S4)CC5=CC=CC=C5
InChI=1SC27H27N3O3Sc3125(281481291528)19291821(2212671323(22)29)162426(32)30(27(33)3424)1720104351120h3710131618H128914151719H2b2416
MFCD04128204
O=C1SC(=Cc2cn(c3c2cccc3)CC(=O)N2CCCCCC2)C(=O)N1Cc1ccccc1
ZINC000009805469
ZINC09805469
ZINC9805469
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