Vitas-M small molecule compound

4-(acetylamino)-N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide

Catalog ID
STK282638
SMILES CC(=O)Nc1ccc(cc1)C(=O)Nc1nnc(s1)C1CC(=O)N(C1)c1ccc(c(c1)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 C23H23N5O3S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O3S/c1-13-4-9-19(10-14(13)2)28-12-17(11-20(28)30)22-26-27-23(32-22)25-21(31)16-5-7-18(8-6-16)24-15(3)29/h4-10,17H,11-12H2,1-3H3,(H,24,29)(H,25,27,31)
InChIKey
FGVBBZBFKVAMLJ-UHFFFAOYSA-N
Synonyms
924971-21-1
4(acetylamino)N(5(1(34dimethylphenyl)5oxopyrrolidin3yl)134thiadiazol2yl)benzamide
4acetamidoN(5(1(34dimethylphenyl)5oxopyrrolidin3yl)134thiadiazol2yl)benzamide
924971211
CC1=C(C=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC=C(C=C4)NC(=O)C)C
InChI=1SC23H23N5O3Sc1134919(1014(13)2)281217(1120(28)30)22262723(3222)2521(31)165718(8616)2415(3)29h41017H1112H213H3(H2429)(H252731)
MFCD09270397
N(4(N(5(1(34DIMETHYLPHENYL)5OXOPYRROLIDIN3YL)134THIADIAZOL2YL)CARBAMOYL)PHENYL)ACETAMIDE
ZINC000009198077
ZINC000009198083

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.