Vitas-M small molecule compound
1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-ethoxyphenyl)-3-hydroxy-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK909038
SMILES CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1cccs1)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 C26H20ClN3O4S3 MW 570.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O4S3/c1-2-34-18-6-3-5-16(13-18)21-20(22(31)19-7-4-12-35-19)23(32)24(33)30(21)25-28-29-26(37-25)36-14-15-8-10-17(27)11-9-15/h3-13,21,32H,2,14H2,1H3InChIKey
GKSYYBJSRXPQGP-UHFFFAOYSA-NSynonyms
1(5((4chlorobenzyl)sulfanyl)134thiadiazol2yl)5(3ethoxyphenyl)3hydroxy4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
1(5((4CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)2(3ETHOXYPHENYL)4HYDROXY3(THIOPHENE2CARBONYL)2HPYRROL5ONE
CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=C(C=C4)Cl)O)C(=O)C5=CC=CS5
InChI=1SC26H20ClN3O4S3c12341863516(1318)2120(22(31)1974123519)23(32)24(33)30(21)25282926(3725)36141581017(27)11915h3132132H214H21H3
MFCD06280529
ZINC000098046592
ZINC000098046593
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