Vitas-M small molecule compound

2-({5-[(4-bromophenyl)sulfonyl]-6-oxo-1,6-dihydropyrimidin-2-yl}sulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

Catalog ID
STL141736
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1ncc(c(=O)[nH]1)S(=O)(=O)c1ccc(cc1)Br

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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 C20H16BrN3O6S2 MW 538.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN3O6S2/c21-12-1-4-14(5-2-12)32(27,28)17-10-22-20(24-19(17)26)31-11-18(25)23-13-3-6-15-16(9-13)30-8-7-29-15/h1-6,9-10H,7-8,11H2,(H,23,25)(H,22,24,26)
InChIKey
AUUQSKIFVARQGQ-UHFFFAOYSA-N
Synonyms
893789-47-4
2((5((4bromophenyl)sulfonyl)6oxo16dihydropyrimidin2yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((5((4BROMOPHENYL)SULFONYL)6OXO16DIHYDROPYRIMIDIN2YL)THIO)N(23DIHYDROBENZO(B)(14)DIOXIN6YL)ACETAMIDE
2((5(4bromophenyl)sulfonyl6oxo1Hpyrimidin2yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
893789474
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC=C(C(=O)N3)S(=O)(=O)C4=CC=C(C=C4)Br
InChI=1SC20H16BrN3O6S2c21121414(5212)32(2728)17102220(2419(17)26)311118(25)2313361516(913)30872915h16910H7811H2(H2325)(H222426)
MFCD08569178
O=C(Nc1ccc2c(c1)OCCO2)CSc1ncc(c(=O)(nH)1)S(=O)(=O)c1ccc(cc1)Br
ZINC000008604702
ZINC8604702

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Available files

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