Vitas-M small molecule compound
3-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]butan-1-one
Catalog ID
STL194258
SMILES CC(n1nc(nc1C)C)CC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1
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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 C18H25N5O3S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N5O3S/c1-14(23-16(3)19-15(2)20-23)13-18(24)21-9-11-22(12-10-21)27(25,26)17-7-5-4-6-8-17/h4-8,14H,9-13H2,1-3H3InChIKey
HUMBREJNNVDYOP-UHFFFAOYSA-NSynonyms
896087-22-21(4(benzenesulfonyl)piperazin1yl)3(35dimethyl124triazol1yl)butan1one
3(35dimethyl1H124triazol1yl)1(4(phenylsulfonyl)piperazin1yl)butan1one
896087222
CC1=NN(C(=N1)C)C(C)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
InChI=1SC18H25N5O3Sc114(2316(3)1915(2)2023)1318(24)2191122(121021)27(2526)177546817h4814H913H213H3
MFCD09250719
ZINC000012420517
ZINC000012420519
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