Vitas-M small molecule compound

2-[(4-amino-6-hydroxypyrimidin-2-yl)sulfanyl]-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone

Catalog ID
STK219982
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)CSc1nc(N)cc(n1)O

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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 C16H18ClN5O2S MW 379.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O2S/c17-11-2-1-3-12(8-11)21-4-6-22(7-5-21)15(24)10-25-16-19-13(18)9-14(23)20-16/h1-3,8-9H,4-7,10H2,(H3,18,19,20,23)
InChIKey
DZDWUORKILBRHH-UHFFFAOYSA-N
Synonyms

2((4AMINO6HYDROXYPYRIMIDIN2YL)SULFANYL)1(4(3CHLOROPHENYL)PIPERAZIN1YL)ETHANONE
6AMINO2(2(4(3CHLOROPHENYL)PIPERAZIN1YL)2OXOETHYL)SULFANYL1HPYRIMIDIN4ONE
C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=NC(=O)C=C(N3)N
InChI=1SC16H18ClN5O2Sc171121312(811)214622(7521)15(24)1025161913(18)914(23)2016h1389H4710H2(H318192023)
MFCD06665462
ZINC000010059905
ZINC10059905

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Available files

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