Vitas-M small molecule compound
3-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK364529
SMILES Clc1ccc(c(c1)N1CCN(CC1)CCCn1c(=S)[nH]c2c(c1=O)cccc2)C
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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 C22H25ClN4OS MW 428.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN4OS/c1-16-7-8-17(23)15-20(16)26-13-11-25(12-14-26)9-4-10-27-21(28)18-5-2-3-6-19(18)24-22(27)29/h2-3,5-8,15H,4,9-14H2,1H3,(H,24,29)InChIKey
VADWMRGMHGNSDY-UHFFFAOYSA-NSynonyms
3(3(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)PROPYL)2SULFANYLIDENE1HQUINAZOLIN4ONE
3(3(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)PROPYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE
3(3(4(5CHLORO2METHYLPHENYL)PIPERAZINYL)PROPYL)2THIOXO13DIHYDROQUINAZOLIN4ONE
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCCN3C(=O)C4=CC=CC=C4NC3=S
Clc1ccc(c(c1)N1CCN(CC1)CCCn1c(=S)(nH)c2c(c1=O)cccc2)C
InChI=1SC22H25ClN4OSc1167817(23)1520(16)26131125(121426)94102721(28)18523619(18)2422(27)29h235815H4914H21H3(H2429)
MFCD05661696
ZINC000004113209
ZINC4113209
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