Vitas-M small molecule compound
4-methoxy-N-[2-methyl-1-(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)propyl]benzamide
Catalog ID
STK497543
SMILES COc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCC(=O)N1CCOCC1)C(C)C
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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 C21H29N5O4S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O4S/c1-14(2)18(22-20(28)15-5-7-16(29-4)8-6-15)19-23-24-21(25(19)3)31-13-17(27)26-9-11-30-12-10-26/h5-8,14,18H,9-13H2,1-4H3,(H,22,28)InChIKey
NZKNDHGTVYIPGZ-UHFFFAOYSA-NSynonyms
4methoxyN(2methyl1(4methyl5((2(morpholin4yl)2oxoethyl)sulfanyl)4H124triazol3yl)propyl)benzamide
4methoxyN(2methyl1(4methyl5(2morpholin4yl2oxoethyl)sulfanyl124triazol3yl)propyl)benzamide
CC(C)C(C1=NN=C(N1C)SCC(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H29N5O4Sc114(2)18(2220(28)155716(294)8615)19232421(25(19)3)311317(27)2691130121026h581418H913H214H3(H2228)
MFCD11854931
ZINC000032579279
ZINC000032579280
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