Vitas-M small molecule compound

N-[4-(phenylamino)phenyl]-3,4-dihydroisoquinoline-2(1H)-carbothioamide

Catalog ID
STK149946
SMILES S=C(N1CCc2c(C1)cccc2)Nc1ccc(cc1)Nc1ccccc1

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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 C22H21N3S MW 359.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3S/c26-22(25-15-14-17-6-4-5-7-18(17)16-25)24-21-12-10-20(11-13-21)23-19-8-2-1-3-9-19/h1-13,23H,14-16H2,(H,24,26)
InChIKey
UOTQBKRMDCUUTI-UHFFFAOYSA-N
Synonyms

C1CN(CC2=CC=CC=C21)C(=S)NC3=CC=C(C=C3)NC4=CC=CC=C4
InChI=1SC22H21N3Sc2622(25151417645718(17)1625)2421121020(111321)23198213919h11323H1416H2(H2426)
MFCD03760158
N(4(PHENYLAMINO)PHENYL)34DIHYDROISOQUINOLINE2(1H)CARBOTHIOAMIDE
N(4ANILINOPHENYL)34DIHYDRO1HISOQUINOLINE2CARBOTHIOAMIDE
ZINC000002841094
ZINC02841094
ZINC2841094

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Available files

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