Vitas-M small molecule compound
N-{3-methoxy-4-[(3-methylbenzyl)oxy]benzyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Catalog ID
STK281356
SMILES COc1cc(CNCCSc2nnnn2C)ccc1OCc1cccc(c1)C
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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 C20H25N5O2S MW 399.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2S/c1-15-5-4-6-17(11-15)14-27-18-8-7-16(12-19(18)26-3)13-21-9-10-28-20-22-23-24-25(20)2/h4-8,11-12,21H,9-10,13-14H2,1-3H3InChIKey
DPJZSHLFSVMNIQ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)COC2=C(C=C(C=C2)CNCCSC3=NN=NN3C)OC
InChI=1SC20H25N5O2Sc11554617(1115)1427188716(1219(18)263)1321910282022232425(20)2h48111221H9101314H213H3
MFCD07410295
N((3METHOXY4((3METHYLPHENYL)METHOXY)PHENYL)METHYL)2(1METHYLTETRAZOL5YL)SULFANYLETHANAMINE
N(3methoxy4((3methylbenzyl)oxy)benzyl)2((1methyl1Htetrazol5yl)sulfanyl)ethanamine
N(3METHOXY4((3METHYLBENZYL)OXY)BENZYL)N(2((1METHYL1HTETRAAZOL5YL)SULFANYL)ETHYL)AMINE
ZINC000009194461
ZINC9194461
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