Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylbutanamide
Catalog ID
STL140433
SMILES CCC(C(=O)NC1CCCCC1)Sc1nnc(n1C(C)C)c1cc2c(o1)cccc2
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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 C23H30N4O2S MW 426.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S/c1-4-20(22(28)24-17-11-6-5-7-12-17)30-23-26-25-21(27(23)15(2)3)19-14-16-10-8-9-13-18(16)29-19/h8-10,13-15,17,20H,4-7,11-12H2,1-3H3,(H,24,28)InChIKey
LKCKCKSDCYUTOG-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(propan2yl)4H124triazol3yl)sulfanyl)Ncyclohexylbutanamide
2((5(1benzofuran2yl)4propan2yl124triazol3yl)sulfanyl)Ncyclohexylbutanamide
CCC(C(=O)NC1CCCCC1)SC2=NN=C(N2C(C)C)C3=CC4=CC=CC=C4O3
InChI=1SC23H30N4O2Sc1420(22(28)2417116571217)3023262521(27(23)15(2)3)19141610891318(16)2919h81013151720H471112H213H3(H2428)
MFCD18434884
ZINC000057291811
ZINC000057291812
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