Vitas-M small molecule compound
2-({5-[3-(4-methoxyphenyl)propyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Catalog ID
STK261064
SMILES COc1ccc(cc1)CCCc1nnc(n1C)SCC(=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 C21H23N3O2S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S/c1-24-20(10-6-7-16-11-13-18(26-2)14-12-16)22-23-21(24)27-15-19(25)17-8-4-3-5-9-17/h3-5,8-9,11-14H,6-7,10,15H2,1-2H3InChIKey
KHOZHFSFNQXNMV-UHFFFAOYSA-NSynonyms
2((5(3(4METHOXYPHENYL)PROPYL)4METHYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(3(4METHOXYPHENYL)PROPYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(5(3(4METHOXYPHENYL)PROPYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)1PHENYLETHANONE
CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CCCC3=CC=C(C=C3)OC
InChI=1SC21H23N3O2Sc12420(106716111318(262)141216)222321(24)271519(25)178435917h35891114H671015H212H3
MFCD08670167
ZINC000006234744
ZINC06234744
ZINC6234744
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