Vitas-M small molecule compound
4-(1,3-benzodioxol-5-ylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
Catalog ID
STK457847
SMILES S=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
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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 C23H24N6O4S2 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O4S2/c30-35(31,27-22-24-8-1-9-25-22)19-5-3-18(4-6-19)26-23(34)29-12-10-28(11-13-29)15-17-2-7-20-21(14-17)33-16-32-20/h1-9,14H,10-13,15-16H2,(H,26,34)(H,24,25,27)InChIKey
POTZNBDUKDHKQC-UHFFFAOYSA-NSynonyms
((4(((4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)PHENYL)SULFONYL)PYRIMIDIN2YLAMINE
4(13benzodioxol5ylmethyl)N(4(pyrimidin2ylsulfamoyl)phenyl)piperazine1carbothioamide
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=S)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5
InChI=1SC23H24N6O4S2c3035(312722248192522)195318(4619)2623(34)29121028(111329)1517272021(1417)33163220h1914H10131516H2(H2634)(H242527)
MFCD04137455
ZINC000002851873
ZINC2851873
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