Vitas-M small molecule compound

N-(3-methoxy-4-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]methoxy}benzyl)butan-2-amine

Catalog ID
STK511497
SMILES CCC(NCc1ccc(c(c1)OC)OCc1nnnn1c1ccc(cc1)C)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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-5-16(3)22-13-17-8-11-19(20(12-17)27-4)28-14-21-23-24-25-26(21)18-9-6-15(2)7-10-18/h6-12,16,22H,5,13-14H2,1-4H3
InChIKey
IVYRBRLOOMHICA-UHFFFAOYSA-N
Synonyms

CCC(C)NCC1=CC(=C(C=C1)OCC2=NN=NN2C3=CC=C(C=C3)C)OC
InChI=1SC21H27N5O2c1516(3)22131781119(20(1217)274)28142123242526(21)189615(2)71018h6121622H51314H214H3
MFCD07412520
N((3METHOXY4((1(4METHYLPHENYL)TETRAZOL5YL)METHOXY)PHENYL)METHYL)BUTAN2AMINE
N(3methoxy4((1(4methylphenyl)1Htetrazol5yl)methoxy)benzyl)butan2amine
N(SECBUTYL)N(3METHOXY4((1(4METHYLPHENYL)1HTETRAAZOL5YL)METHOXY)BENZYL)AMINE
ZINC000007540396
ZINC000007540401

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.