Vitas-M small molecule compound
5-(4-tert-butylphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK798440
SMILES Cc1nnc(s1)N1C(c2ccc(cc2)C(C)(C)C)C(=C(C1=O)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 C22H21N3O3S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S2/c1-12-23-24-21(30-12)25-17(13-7-9-14(10-8-13)22(2,3)4)16(19(27)20(25)28)18(26)15-6-5-11-29-15/h5-11,17,27H,1-4H3InChIKey
IZGGDNJNFCHEBB-UHFFFAOYSA-NSynonyms
2(4TERTBUTYLPHENYL)4HYDROXY1(5METHYL134THIADIAZOL2YL)3(THIOPHENE2CARBONYL)2HPYRROL5ONE
5(4tertbutylphenyl)3hydroxy1(5methyl134thiadiazol2yl)4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
CC1=NN=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC22H21N3O3S2c112232421(3012)2517(137914(10813)22(23)4)16(19(27)20(25)28)18(26)1565112915h5111727H14H3
MFCD03444812
ZINC000001474124
ZINC000001474125
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