Vitas-M small molecule compound
3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-5-(3-ethoxyphenyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL339168
SMILES CCOc1cccc(c1)c1nnc(n1N)SCc1nc2c([nH]1)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 C18H18N6OS MW 366.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6OS/c1-2-25-13-7-5-6-12(10-13)17-22-23-18(24(17)19)26-11-16-20-14-8-3-4-9-15(14)21-16/h3-10H,2,11,19H2,1H3,(H,20,21)InChIKey
GTNAAGQFMNSRCX-UHFFFAOYSA-NSynonyms
678189-72-53(((1Hbenzo(d)imidazol2yl)methyl)thio)5(3ethoxyphenyl)4H124triazol4amine
3((1Hbenzimidazol2ylmethyl)sulfanyl)5(3ethoxyphenyl)4H124triazol4amine
3(1HBENZIMIDAZOL2YLMETHYLSULFANYL)5(3ETHOXYPHENYL)124TRIAZOL4AMINE
3(BENZIMIDAZOL2YLMETHYLTHIO)5(3ETHOXYPHENYL)124TRIAZOLE4YLAMINE
678189725
CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=NC4=CC=CC=C4N3
CCOc1cccc(c1)c1nnc(n1N)SCc1nc2c((nH)1)cccc2
InChI=1SC18H18N6OSc12251375612(1013)17222318(24(17)19)2611162014834915(14)2116h310H21119H21H3(H2021)
MFCD04009245
ZINC000005054462
ZINC05054462
ZINC5054462
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