Vitas-M small molecule compound
N-[2-({2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-methylbenzamide
Catalog ID
STK674747
SMILES O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C
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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 C28H25N5O3S2 MW 543.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O3S2/c1-17-9-7-8-12-21(17)26(35)29-19-13-14-22-23(15-19)38-28(30-22)37-16-24(34)31-25-18(2)32(3)33(27(25)36)20-10-5-4-6-11-20/h4-15H,16H2,1-3H3,(H,29,35)(H,31,34)InChIKey
XIBJTWRJHOGHPO-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC28H25N5O3S2c1179781221(17)26(35)291913142223(1519)3828(3022)371624(34)312518(2)32(3)33(27(25)36)20105461120h415H16H213H3(H2935)(H3134)
MFCD01203809
N(2((2((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)2oxoethyl)sulfanyl)13benzothiazol6yl)2methylbenzamide
N(2(2((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2METHYLBENZAMIDE
ZINC000002188902
ZINC2188902
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