Vitas-M small molecule compound
4-({5-[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
Catalog ID
STK282648
SMILES CC(=O)Oc1ccc(cc1)C(=O)Nc1nnc(s1)C1CC(=O)N(C1)c1ccc(c(c1)Cl)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 C22H19ClN4O4S MW 470.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O4S/c1-12-3-6-16(10-18(12)23)27-11-15(9-19(27)29)21-25-26-22(32-21)24-20(30)14-4-7-17(8-5-14)31-13(2)28/h3-8,10,15H,9,11H2,1-2H3,(H,24,26,30)InChIKey
XCQJPFYZGUWPNJ-UHFFFAOYSA-NSynonyms
924971-41-5(4((5(1(3chloro4methylphenyl)5oxopyrrolidin3yl)134thiadiazol2yl)carbamoyl)phenyl)acetate
4((5(1(3chloro4methylphenyl)5oxopyrrolidin3yl)134thiadiazol2yl)carbamoyl)phenylacetate
4(N(5(1(3CHLORO4METHYLPHENYL)5OXOPYRROLIDIN3YL)134THIADIAZOL2YL)CARBAMOYL)PHENYLACETATE
924971415
CC1=C(C=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC=C(C=C4)OC(=O)C)Cl
InChI=1SC22H19ClN4O4Sc1123616(1018(12)23)271115(919(27)29)21252622(3221)2420(30)144717(8514)3113(2)28h381015H911H212H3(H242630)
MFCD09270407
ZINC000009198167
ZINC000009198169
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