Vitas-M small molecule compound
5-[4-(benzyloxy)-3-ethoxyphenyl]-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK800490
SMILES CCOc1cc(ccc1OCc1ccccc1)C1C(=C(C(=O)N1c1nnc(s1)C)O)C(=O)c1cccs1
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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 C27H23N3O5S2 MW 533.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O5S2/c1-3-34-20-14-18(11-12-19(20)35-15-17-8-5-4-6-9-17)23-22(24(31)21-10-7-13-36-21)25(32)26(33)30(23)27-29-28-16(2)37-27/h4-14,23,32H,3,15H2,1-2H3InChIKey
KAZBTSVKDNAJST-UHFFFAOYSA-NSynonyms
2(3ETHOXY4PHENYLMETHOXYPHENYL)4HYDROXY1(5METHYL134THIADIAZOL2YL)3(THIOPHENE2CARBONYL)2HPYRROL5ONE
5(4(benzyloxy)3ethoxyphenyl)3hydroxy1(5methyl134thiadiazol2yl)4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)C)O)C(=O)C4=CC=CS4)OCC5=CC=CC=C5
InChI=1SC27H23N3O5S2c1334201418(111219(20)3515178546917)2322(24(31)21107133621)25(32)26(33)30(23)27292816(2)3727h4142332H315H212H3
MFCD04212984
ZINC000006458590
ZINC000006458591
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