For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4,7-Diamino-5-(3-chlorophenyl)-2-(methylsulfanyl)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
SpectraBase Compound ID 8ULM2yQ5yT
InChI InChI=1S/C15H12ClN5OS/c1-23-15-20-12(18)11-10(7-3-2-4-8(16)5-7)9(6-17)13(19)22-14(11)21-15/h2-5,10H,19H2,1H3,(H2,18,20,21)
InChIKey KPBZYAASHYKRTF-UHFFFAOYSA-N
Mol Weight 345.81 g/mol
Molecular Formula C15H12ClN5OS
Exact Mass 345.045109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KVznqYmQRdc
Name 4,7-Diamino-5-(3-chlorophenyl)-2-(methylsulfanyl)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Alternate Name(s) 4,7-bis(azanyl)-5-(3-chlorophenyl)-2-methylsulfanyl-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile 4,7-Diamino-5-(3-chlorophenyl)-2-(methylthio)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile 5H-Pyrano[2,3-d]pyrimidine-6-carbonitrile, 4,7-diamino-5-(3-chlorophenyl)-2-(methylthio)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN5OS
InChI InChI=1S/C15H12ClN5OS/c1-23-15-20-12(18)11-10(7-3-2-4-8(16)5-7)9(6-17)13(19)22-14(11)21-15/h2-5,10H,19H2,1H3,(H2,18,20,21)
InChIKey KPBZYAASHYKRTF-UHFFFAOYSA-N
Molecular Weight 345.808 g/mol
SMILES Nc1c2c(OC(=C(C2c2cccc(c2)Cl)C#N)N)nc(n1)SC
SPLASH splash10-001i-9660000000-ad368911dd59e7161d23
Wiley ID 1449353