Vitas-M small molecule compound
(3E)-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-7-methyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK781599
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\2/C(=O)Nc3c2cccc3C)/C1=O
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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 C21H18N2O3S2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3S2/c1-12-4-3-5-15-16(19(24)22-17(12)15)18-20(25)23(21(27)28-18)11-10-13-6-8-14(26-2)9-7-13/h3-9H,10-11H2,1-2H3,(H,22,24)/b18-16+InChIKey
LRNXEVVZDWATGR-FBMGVBCBSA-NSynonyms
(3E)3(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)7methyl13dihydro2Hindol2one
(5E)3(2(4METHOXYPHENYL)ETHYL)5(7METHYL2OXO1HINDOL3YLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=CC=CC2=C1NC(=O)C2=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC
COc1ccc(cc1)CCN1C(=S)SC(=C2C(=O)Nc3c2cccc3C)C1=O
InChI=1SC21H18N2O3S2c1124351516(19(24)2217(12)15)1820(25)23(21(27)2818)1110136814(262)9713h39H1011H212H3(H2224)b1816+
MFCD06015372
ZINC000004722208
ZINC04722208
ZINC4722208
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