Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL251325
SMILES O=C(c1c(C)nn(c1C)C1CCS(=O)(=O)C1)Nc1nc2c(s1)cccc2
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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 C17H18N4O3S2 MW 390.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3S2/c1-10-15(11(2)21(20-10)12-7-8-26(23,24)9-12)16(22)19-17-18-13-5-3-4-6-14(13)25-17/h3-6,12H,7-9H2,1-2H3,(H,18,19,22)InChIKey
JDBHJGAEDSYQNT-UHFFFAOYSA-NSynonyms
1374539-28-21374539282
CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)C(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC17H18N4O3S2c11015(11(2)21(2010)127826(2324)912)16(22)19171813534614(13)2517h3612H79H212H3(H181922)
MFCD22202017
N(13benzothiazol2yl)1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxamide
N(13benzothiazol2yl)1(11dioxothiolan3yl)35dimethylpyrazole4carboxamide
N(benzo(d)thiazol2yl)1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazole4carboxamide
ZINC000072403206
ZINC000072403207
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