4-METHYL-2-[(6-METHYL-4-OXO-1,4-DIHYDROPYRIMIDIN-2-YL)SULFANYL]BENZONITRILE

CAS No.
CCD No.
CCD03717754
Formula
C13 H11 N3 O S
MolWeight
257.316

Basic Information

Product Name: 4-METHYL-2-[(6-METHYL-4-OXO-1,4-DIHYDROPYRIMIDIN-2-YL)SULFANYL]BENZONITRILE
English Synonyms: 4-METHYL-2-[(6-METHYL-4-OXO-1,4-DIHYDROPYRIMIDIN-2-YL)SULFANYL]BENZONITRILE
MDL Number.: MFCD17464912
H bond acceptor: 4
H bond donor: 1
Smile: Cc1ccc(c(c1)Sc2[nH]c(cc(=O)n2)C)C#N
InChi: InChI=1S/C13H11N3OS/c1-8-3-4-10(7-14)11(5-8)18-13-15-9(2)6-12(17)16-13/h3-6H,1-2H3,(H,15,16,17)
InChiKey: InChIKey=DBXXKHWCLUGUGN-UHFFFAOYSA-N

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