Vitas-M small molecule compound
ethyl 3-{[({4-ethyl-5-[3-(4-methoxyphenyl)propyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK336190
SMILES CCOC(=O)c1cccc(c1)NC(=O)CSc1nnc(n1CC)CCCc1ccc(cc1)OC
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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 C25H30N4O4S MW 482.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O4S/c1-4-29-22(11-6-8-18-12-14-21(32-3)15-13-18)27-28-25(29)34-17-23(30)26-20-10-7-9-19(16-20)24(31)33-5-2/h7,9-10,12-16H,4-6,8,11,17H2,1-3H3,(H,26,30)InChIKey
TYTVLBBUUIXHOC-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)OCC)CCCC3=CC=C(C=C3)OC
ETHYL3((((4ETHYL5(3(4METHOXYPHENYL)PROPYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ethyl3((2((4ethyl5(3(4methoxyphenyl)propyl)124triazol3yl)sulfanyl)acetyl)amino)benzoate
InChI=1SC25H30N4O4Sc142922(116818121421(323)151318)272825(29)341723(30)2620107919(1620)24(31)3352h79101216H4681117H213H3(H2630)
MFCD04378690
ZINC000018201283
ZINC18201283
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