Vitas-M small molecule compound

4-(2,6-dichlorobenzyl)-N-(4-methyl-2-oxo-2H-chromen-7-yl)piperazine-1-carbothioamide

Catalog ID
STK443073
SMILES S=C(N1CCN(CC1)Cc1c(Cl)cccc1Cl)Nc1ccc2c(c1)oc(=O)cc2C

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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 C22H21Cl2N3O2S MW 462.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N3O2S/c1-14-11-21(28)29-20-12-15(5-6-16(14)20)25-22(30)27-9-7-26(8-10-27)13-17-18(23)3-2-4-19(17)24/h2-6,11-12H,7-10,13H2,1H3,(H,25,30)
InChIKey
PKRBFWQOISGQCI-UHFFFAOYSA-N
Synonyms

4((26dichlorophenyl)methyl)N(4methyl2oxochromen7yl)piperazine1carbothioamide
4(26dichlorobenzyl)N(4methyl2oxo2Hchromen7yl)piperazine1carbothioamide
7(((4((26DICHLOROPHENYL)METHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)4METHYLCHROMEN2ONE
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)N3CCN(CC3)CC4=C(C=CC=C4Cl)Cl
InChI=1SC22H21Cl2N3O2Sc1141121(28)29201215(5616(14)20)2522(30)279726(81027)131718(23)32419(17)24h261112H71013H21H3(H2530)
MFCD04054594
ZINC000050106693
ZINC50106693

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Available files

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