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

*Links on SpectraBase are not permalinks.
5-Benzyl-4-imino-6-oxo-2-thioxohexahydro-5-pyrimidinylformamide
SpectraBase Compound ID KpbBSuBdvLK
InChI InChI=1S/C12H12N4O2S/c13-9-12(14-7-17,10(18)16-11(19)15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,14,17)(H3,13,15,16,18,19)
InChIKey NQFCFGIVOWZSNN-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C12H12N4O2S
Exact Mass 276.068097 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 G2MaCTz32aL
Name 5-Benzyl-4-imino-6-oxo-2-thioxohexahydro-5-pyrimidinylformamide
CAS Registry Number 126552-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N4O2S
InChI InChI=1S/C12H12N4O2S/c13-9-12(14-7-17,10(18)16-11(19)15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,14,17)(H3,13,15,16,18,19)
InChIKey NQFCFGIVOWZSNN-UHFFFAOYSA-N
Molecular Weight 276.314 g/mol
SMILES NC=1C(Cc2ccccc2)(C(N=C(N1)S)=O)NC=O
SPLASH splash10-0006-9430000000-858ea0290eab486f54b6
Source of Spectrum O-24-874-7
Synonyms 5-Benzyl-5-formylamido-6-imino-1,2,5,6-tetrahydro-2(1H)-thioxopyrimidin-4(3H)-one 5-Benzyl-5-formylamino-6-imino-hexahydro-2-thioxopyrimidin-4-one N-(4-amino-5-benzyl-6-keto-2-thioxo-pyrimidin-5-yl)formamide N-(4-amino-5-benzyl-6-oxo-2-sulfanylidenepyrimidin-5-yl)formamide N-(4-amino-5-benzyl-6-oxo-2-thioxo-pyrimidin-5-yl)formamide N-[4-amino-6-oxo-5-(phenylmethyl)-2-sulfanylidene-5-pyrimidinyl]formamide N-[4-azanyl-6-oxidanylidene-5-(phenylmethyl)-2-sulfanylidene-pyrimidin-5-yl]methanamide
Wiley ID 1279621