Vitas-M small molecule compound
5-{5-[(4-bromophenoxy)methyl]furan-2-yl}-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306416
SMILES Brc1ccc(cc1)OCc1ccc(o1)c1nnc(n1CC1CCCO1)S
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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 C18H18BrN3O3S MW 436.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O3S/c19-12-3-5-13(6-4-12)24-11-15-7-8-16(25-15)17-20-21-18(26)22(17)10-14-2-1-9-23-14/h3-8,14H,1-2,9-11H2,(H,21,26)InChIKey
YHKPFDVINHRGSN-UHFFFAOYSA-NSynonyms
828279-39-63(5((4BROMOPHENOXY)METHYL)FURAN2YL)4(OXOLAN2YLMETHYL)1H124TRIAZOLE5THIONE
5(5((4bromophenoxy)methyl)furan2yl)4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
828279396
C1CC(OC1)CN2C(=NNC2=S)C3=CC=C(O3)COC4=CC=C(C=C4)Br
InChI=1SC18H18BrN3O3Sc19123513(6412)2411157816(2515)17202118(26)22(17)10142192314h3814H12911H2(H2126)
MFCD04047768
ZINC000002790257
ZINC000002790258
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