Vitas-M small molecule compound
2-[({[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STL194126
SMILES CN1CCN(CC1)c1ccnc(n1)SCC(=O)Nc1ccccc1C(=O)O
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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 C18H21N5O3S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O3S/c1-22-8-10-23(11-9-22)15-6-7-19-18(21-15)27-12-16(24)20-14-5-3-2-4-13(14)17(25)26/h2-7H,8-12H2,1H3,(H,20,24)(H,25,26)InChIKey
JZJRADISOVSPQA-UHFFFAOYSA-NSynonyms
2((((4(4methylpiperazin1yl)pyrimidin2yl)sulfanyl)acetyl)amino)benzoicacid
2((2(4(4methylpiperazin1yl)pyrimidin2yl)sulfanylacetyl)amino)benzoicacid
CN1CCN(CC1)C2=NC(=NC=C2)SCC(=O)NC3=CC=CC=C3C(=O)O
InChI=1SC18H21N5O3Sc12281023(11922)15671918(2115)271216(24)2014532413(14)17(25)26h27H812H21H3(H2024)(H2526)
MFCD22391153
ZINC000072265535
ZINC72265535
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