Vitas-M small molecule compound

(1-benzyl-1H-indol-3-yl)(4-methylpiperazin-1-yl)methanethione

Catalog ID
STL431120
SMILES CN1CCN(CC1)C(=S)c1cn(c2c1cccc2)Cc1ccccc1

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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 C21H23N3S MW 349.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3S/c1-22-11-13-23(14-12-22)21(25)19-16-24(15-17-7-3-2-4-8-17)20-10-6-5-9-18(19)20/h2-10,16H,11-15H2,1H3
InChIKey
POKKEYSIMHQKNT-UHFFFAOYSA-N
Synonyms

(1benzyl1Hindol3yl)(4methylpiperazin1yl)methanethione
(1BENZYLINDOL3YL)(4METHYLPIPERAZIN1YL)METHANETHIONE
1BENZYL3((4METHYLPIPERAZIN1YL)CARBONOTHIOYL)1HINDOLE
CN1CCN(CC1)C(=S)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4
InChI=1SC21H23N3Sc122111323(141222)21(25)191624(15177324817)201065918(19)20h21016H1115H21H3
MFCD03306320
ZINC000000555715
ZINC555715

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Available files

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