Vitas-M small molecule compound
ethyl 4-[5-(furan-2-ylmethyl)-2-thioxo-1,3,5-triazinan-1-yl]benzoate
Catalog ID
STL168728
SMILES CCOC(=O)c1ccc(cc1)N1CN(CNC1=S)Cc1ccco1
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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 C17H19N3O3S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S/c1-2-22-16(21)13-5-7-14(8-6-13)20-12-19(11-18-17(20)24)10-15-4-3-9-23-15/h3-9H,2,10-12H2,1H3,(H,18,24)InChIKey
OSEWYQDUXXCASX-UHFFFAOYSA-NSynonyms
685130-65-8685130658
CCOC(=O)C1=CC=C(C=C1)N2CN(CNC2=S)CC3=CC=CO3
ETHYL4(5(FURAN2YLMETHYL)2SULFANYLIDENE135TRIAZINAN1YL)BENZOATE
ethyl4(5(furan2ylmethyl)2thioxo135triazinan1yl)benzoate
InChI=1SC17H19N3O3Sc122216(21)135714(8613)201219(111817(20)24)10154392315h39H21012H21H3(H1824)
MFCD03673887
ZINC000020171117
ZINC20171117
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