Vitas-M small molecule compound
3-methyl-N-[2-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
Catalog ID
STK232864
SMILES O=C(Nc1ccccc1C)CSc1sc2c(n1)ccc(c2)NC(=O)c1cccc(c1)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 C24H21N3O2S2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O2S2/c1-15-6-5-8-17(12-15)23(29)25-18-10-11-20-21(13-18)31-24(27-20)30-14-22(28)26-19-9-4-3-7-16(19)2/h3-13H,14H2,1-2H3,(H,25,29)(H,26,28)InChIKey
TYMDBAMDIWWDLK-UHFFFAOYSA-NSynonyms
3METHYLN(2((2((2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)BENZAMIDE
3METHYLN(2(2(2METHYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4C
InChI=1SC24H21N3O2S2c11565817(1215)23(29)251810112021(1318)3124(2720)301422(28)2619943716(19)2h313H14H212H3(H2529)(H2628)
MFCD03876473
ZINC000001136969
ZINC01136969
ZINC1136969
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