Vitas-M small molecule compound

N-(4-chlorophenyl)-2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide

Catalog ID
STK121778
SMILES N#Cc1c(=O)[nH]c(nc1c1ccccc1)SCC(=O)Nc1ccc(cc1)Cl

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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 C19H13ClN4O2S MW 396.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN4O2S/c20-13-6-8-14(9-7-13)22-16(25)11-27-19-23-17(12-4-2-1-3-5-12)15(10-21)18(26)24-19/h1-9H,11H2,(H,22,25)(H,23,24,26)
InChIKey
PLQKZXQQLALJNC-UHFFFAOYSA-N
Synonyms
126277-97-2
126277972
C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC(=O)NC3=CC=C(C=C3)Cl)C#N
InChI=1SC19H13ClN4O2Sc20136814(9713)2216(25)1127192317(124213512)15(1021)18(26)2419h19H11H2(H2225)(H232426)
MFCD02020536
N#Cc1c(=O)(nH)c(nc1c1ccccc1)SCC(=O)Nc1ccc(cc1)Cl
N(4CHLOROPHENYL)2((5CYANO4OXO6PHENYL1HPYRIMIDIN2YL)SULFANYL)ACETAMIDE
N(4CHLOROPHENYL)2((5CYANO6OXO4PHENYL16DIHYDROPYRIMIDIN2YL)SULFANYL)ACETAMIDE
N(4CHLOROPHENYL)2((5CYANO6OXO4PHENYL1HPYRIMIDIN2YL)SULFANYL)ACETAMIDE
ZINC000001106211
ZINC01106211
ZINC1106211

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Available files

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