Vitas-M small molecule compound

ethyl 4-{[(4-benzylpiperidin-1-yl)carbonothioyl]amino}benzoate

Catalog ID
STK062219
SMILES CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)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 C22H26N2O2S MW 382.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O2S/c1-2-26-21(25)19-8-10-20(11-9-19)23-22(27)24-14-12-18(13-15-24)16-17-6-4-3-5-7-17/h3-11,18H,2,12-16H2,1H3,(H,23,27)
InChIKey
CQSBZFDHOCOZSI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)CC3=CC=CC=C3
CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)Cc1ccccc1
ETHYL4(((4BENZYLPIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
ETHYL4(((4BENZYLPIPERIDIN1YL)CARBOTHIOYL)AMINO)BENZOATE
ETHYL4(((4BENZYLPIPERIDYL)THIOXOMETHYL)AMINO)BENZOATE
ETHYL4((4BENZYLPIPERIDINE1CARBOTHIOYL)AMINO)BENZOATE
InChI=1SC22H26N2O2Sc122621(25)1981020(11919)2322(27)24141218(131524)16176435717h31118H21216H21H3(H2327)
MFCD03352567
STK062219
ZINC000000986493
ZINC00986493
ZINC986493

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Available files

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