Vitas-M small molecule compound

1-(4-benzylpiperazin-1-yl)-2-{[5-(3-chloro-4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK205753
SMILES C=CCn1c(SCC(=O)N2CCN(CC2)Cc2ccccc2)nnc1c1ccc(c(c1)Cl)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 C25H28ClN5OS MW 482.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5OS/c1-3-11-31-24(21-10-9-19(2)22(26)16-21)27-28-25(31)33-18-23(32)30-14-12-29(13-15-30)17-20-7-5-4-6-8-20/h3-10,16H,1,11-15,17-18H2,2H3
InChIKey
MFLAQIMGTMOHLH-UHFFFAOYSA-N
Synonyms
1(4BENZYLPIPERAZIN1YL)2((5(3CHLORO4METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4BENZYLPIPERAZIN1YL)2((5(3CHLORO4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANONE
4ALLYL5(3CHLORO4METHYLPHENYL)4H124TRIAZOL3YL2(4BENZYL1PIPERAZINYL)2OXOETHYLSULFIDE
CC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl
Registry IDs
MFCD04388933
ZINC000019899302
ZINC19899302

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Available files

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