Vitas-M small molecule compound
1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)-2-phenyl-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
Catalog ID
STK292277
SMILES COc1ccc2c(c1)C(=CC(N2C(=O)C(c1ccccc1)Sc1nn(c(=S)s1)c1ccccc1)(C)C)C
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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 C29H27N3O2S3 MW 545.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O2S3/c1-19-18-29(2,3)31(24-16-15-22(34-4)17-23(19)24)26(33)25(20-11-7-5-8-12-20)36-27-30-32(28(35)37-27)21-13-9-6-10-14-21/h5-18,25H,1-4H3InChIKey
YWVVKZXGDKGJDJ-UHFFFAOYSA-NSynonyms
1(6METHOXY224TRIMETHYL(12DIHYDROQUINOLYL))2PHENYL2(3PHENYL2THIOXO(134THIADIAZOLIN5YLTHIO))ETHAN1ONE
1(6methoxy224trimethylquinolin1(2H)yl)2phenyl2((4phenyl5thioxo45dihydro134thiadiazol2yl)sulfanyl)ethanone
1(6methoxy224trimethylquinolin1yl)2phenyl2((4phenyl5sulfanylidene134thiadiazol2yl)sulfanyl)ethanone
CC1=CC(N(C2=C1C=C(C=C2)OC)C(=O)C(C3=CC=CC=C3)SC4=NN(C(=S)S4)C5=CC=CC=C5)(C)C
InChI=1SC29H27N3O2S3c1191829(23)31(24161522(344)1723(19)24)26(33)25(20117581220)36273032(28(35)3727)211396101421h51825H14H3
MFCD08723604
ZINC000100139134
ZINC000100139137
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