Vitas-M small molecule compound
N-[(E)-(4-{2-[(4-chlorophenyl)sulfanyl]ethoxy}-3-methoxyphenyl)methylidene]-4H-1,2,4-triazol-3-amine
Catalog ID
STK380460
SMILES COc1cc(ccc1OCCSc1ccc(cc1)Cl)/C=N/c1nnc[nH]1
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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 C18H17ClN4O2S MW 388.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O2S/c1-24-17-10-13(11-20-18-21-12-22-23-18)2-7-16(17)25-8-9-26-15-5-3-14(19)4-6-15/h2-7,10-12H,8-9H2,1H3,(H,21,22,23)/b20-11+InChIKey
VPEYDORYPUDWJR-RGVLZGJSSA-NSynonyms
(E)1(4(2(4chlorophenyl)sulfanylethoxy)3methoxyphenyl)N(1H124triazol5yl)methanimine
4((1E)2(4H124TRIAZOL3YL)2AZAVINYL)1(2(4CHLOROPHENYLTHIO)ETHOXY)2METHOXYBENZENE
COC1=C(C=CC(=C1)C=NC2=NC=NN2)OCCSC3=CC=C(C=C3)Cl
COc1cc(ccc1OCCSc1ccc(cc1)Cl)C=Nc1nnc(nH)1
InChI=1SC18H17ClN4O2Sc124171013(1120182112222318)2716(17)258926155314(19)4615h271012H89H21H3(H212223)b2011+
MFCD02125587
N((E)(4(2((4chlorophenyl)sulfanyl)ethoxy)3methoxyphenyl)methylidene)4H124triazol3amine
ZINC000006735924
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