Vitas-M small molecule compound

2,5-diphenyl-1H-pyrrole-3,4-diyl bis(thiocyanate)

Catalog ID
STK366555
SMILES N#CSc1c([nH]c(c1SC#N)c1ccccc1)c1ccccc1

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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 C18H11N3S2 MW 333.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11N3S2/c19-11-22-17-15(13-7-3-1-4-8-13)21-16(18(17)23-12-20)14-9-5-2-6-10-14/h1-10,21H
InChIKey
HYALBCCVBXVEDY-UHFFFAOYSA-N
Synonyms
438539-30-1
(25DIPHENYL4THIOCYANATO1HPYRROL3YL)THIOCYANATE
(4CYANOTHIO25DIPHENYLPYRROL3YL)THIOCARBONITRILE
25diphenyl1Hpyrrole34diylbis(thiocyanate)
438539301
C1=CC=C(C=C1)C2=C(C(=C(N2)C3=CC=CC=C3)SC#N)SC#N
InChI=1SC18H11N3S2c1911221715(137314813)2116(18(17)231220)1495261014h11021H
MFCD00848861
N#CSc1c((nH)c(c1SC#N)c1ccccc1)c1ccccc1
ZINC000100858600
ZINC100858600

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Available files

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