Vitas-M small molecule compound

N-[(1-methyl-1H-pyrrol-2-yl)methyl]-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine

Catalog ID
STK512586
SMILES Cn1cccc1CNCCCSc1nnnn1c1ccccc1

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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 C16H20N6S MW 328.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6S/c1-21-11-5-9-15(21)13-17-10-6-12-23-16-18-19-20-22(16)14-7-3-2-4-8-14/h2-5,7-9,11,17H,6,10,12-13H2,1H3
InChIKey
ZLRPINDCZZFQOI-UHFFFAOYSA-N
Synonyms

CN1C=CC=C1CNCCCSC2=NN=NN2C3=CC=CC=C3
InChI=1SC16H20N6Sc121115915(21)131710612231618192022(16)147324814h25791117H6101213H21H3
MFCD08235311
N((1METHYL1HPYRROL2YL)METHYL)3((1PHENYL1HTETRAAZOL5YL)SULFANYL)1PROPANAMINE
N((1methyl1Hpyrrol2yl)methyl)3((1phenyl1Htetrazol5yl)sulfanyl)propan1amine
N((1methylpyrrol2yl)methyl)3(1phenyltetrazol5yl)sulfanylpropan1amine
ZINC000016382556
ZINC16382556

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Available files

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