Vitas-M small molecule compound

N-[2-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-4-methylbenzamide

Catalog ID
STK032422
SMILES O=C(Nc1ccc(cc1)C(=O)C)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1)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 C25H21N3O3S2 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3S2/c1-15-3-5-18(6-4-15)24(31)27-20-11-12-21-22(13-20)33-25(28-21)32-14-23(30)26-19-9-7-17(8-10-19)16(2)29/h3-13H,14H2,1-2H3,(H,26,30)(H,27,31)
InChIKey
YJIMXNZIDKYQDT-UHFFFAOYSA-N
Synonyms
311796-28-8
311796288
CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=C(C=C4)C(=O)C
InChI=1SC25H21N3O3S2c1153518(6415)24(31)272011122122(1320)3325(2821)321423(30)26199717(81019)16(2)29h313H14H212H3(H2630)(H2731)
MFCD00762683
N(2((2((4ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)4METHYLBENZAMIDE
N(2((2((4acetylphenyl)amino)2oxoethyl)thio)benzo(d)thiazol6yl)4methylbenzamide
N(2(2(4ACETYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)4METHYLBENZAMIDE
O=C(Nc1ccc(cc1)C(=O)C)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1)C
STK032422
ZINC000000705412
ZINC00705412
ZINC705412

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Available files

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