Vitas-M small molecule compound

4-(3-chlorophenyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK873788
SMILES COc1ccc(cc1)NC(=S)N1CCN(CC1)c1cccc(c1)Cl

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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 C18H20ClN3OS MW 361.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3OS/c1-23-17-7-5-15(6-8-17)20-18(24)22-11-9-21(10-12-22)16-4-2-3-14(19)13-16/h2-8,13H,9-12H2,1H3,(H,20,24)
InChIKey
YSYRKVVMYXMFBN-UHFFFAOYSA-N
Synonyms

(4(3CHLOROPHENYL)PIPERAZINYL)((4METHOXYPHENYL)AMINO)METHANE1THIONE
4(3chlorophenyl)N(4methoxyphenyl)piperazine1carbothioamide
COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)Cl
InChI=1SC18H20ClN3OSc123177515(6817)2018(24)2211921(101222)1642314(19)1316h2813H912H21H3(H2024)
MFCD02827719
ZINC000001468044
ZINC01468044
ZINC1468044

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Available files

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